CAS RN: 68002-44-8
CAS Name: 2-(chloromethyl)oxirane; formaldehyde; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 2-methyl-2-propenoic acid; phenol
OPENEYE Name: 2-(chloromethyl)oxirane; formaldehyde; 4-[1-(4-hydroxyphenyl)-1-methyl-ethyl]phenol; 2-methylprop-2-enoic acid; phenol
IUPAC Name: 2-(chloromethyl)oxirane; formaldehyde; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 2-methylprop-2-enoic acid; phenol
SYSTEMATIC NAME: 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; methanal; 2-methylprop-2-enoic acid; phenol
MOLECULAR FORMULA: C29H35ClO7
MOLECULAR WEIGHT: 531.037
SMILES: CC(=C)C(=O)O.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C=O.C1C(O1)CCl.C1=CC=C(C=C1)O
Structure:
CAS RN: 68002-42-6
CAS Name: 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 2-methyl-1H-imidazole
OPENEYE Name: 2-(chloromethyl)oxirane; 4-[1-(4-hydroxyphenyl)-1-methyl-ethyl]phenol; 2-methyl-1H-imidazole
IUPAC Name: 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 2-methyl-1H-imidazole
SYSTEMATIC NAME: 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 2-methyl-1H-imidazole
MOLECULAR FORMULA: C22H27ClN2O3
MOLECULAR WEIGHT: 402.91438
SMILES: CC1=NC=CN1.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1C(O1)CCl
Structure:
CAS RN: 68002-26-6
CAS Name: formaldehyde; 6-phenyl-1,3,5-triazine-2,4-diamine
OPENEYE Name: formaldehyde; 6-phenyl-1,3,5-triazine-2,4-diamine
IUPAC Name: formaldehyde; 6-phenyl-1,3,5-triazine-2,4-diamine
SYSTEMATIC NAME: methanal; 6-phenyl-1,3,5-triazine-2,4-diamine
MOLECULAR FORMULA: C10H11N5O
MOLECULAR WEIGHT: 217.22724
SMILES: C=O.C1=CC=C(C=C1)C2=NC(=NC(=N2)N)N
Structure:
CAS RN: 68130-56-3
CAS Name: formaldehyde; 6-phenyl-1,3,5-triazine-2,4-diamine
OPENEYE Name: formaldehyde; 6-phenyl-1,3,5-triazine-2,4-diamine
IUPAC Name: formaldehyde; 6-phenyl-1,3,5-triazine-2,4-diamine
SYSTEMATIC NAME: methanal; 6-phenyl-1,3,5-triazine-2,4-diamine
MOLECULAR FORMULA: C10H11N5O
MOLECULAR WEIGHT: 217.22724
SMILES: C=O.C1=CC=C(C=C1)C2=NC(=NC(=N2)N)N
Structure:
CAS RN: 68511-72-8
CAS Name: formaldehyde; 6-phenyl-1,3,5-triazine-2,4-diamine
OPENEYE Name: formaldehyde; 6-phenyl-1,3,5-triazine-2,4-diamine
IUPAC Name: formaldehyde; 6-phenyl-1,3,5-triazine-2,4-diamine
SYSTEMATIC NAME: methanal; 6-phenyl-1,3,5-triazine-2,4-diamine
MOLECULAR FORMULA: C10H11N5O
MOLECULAR WEIGHT: 217.22724
SMILES: C=O.C1=CC=C(C=C1)C2=NC(=NC(=N2)N)N
Structure:
CAS RN: 68609-32-5
CAS Name: formaldehyde; 6-phenyl-1,3,5-triazine-2,4-diamine
OPENEYE Name: formaldehyde; 6-phenyl-1,3,5-triazine-2,4-diamine
IUPAC Name: formaldehyde; 6-phenyl-1,3,5-triazine-2,4-diamine
SYSTEMATIC NAME: methanal; 6-phenyl-1,3,5-triazine-2,4-diamine
MOLECULAR FORMULA: C10H11N5O
MOLECULAR WEIGHT: 217.22724
SMILES: C=O.C1=CC=C(C=C1)C2=NC(=NC(=N2)N)N
Structure:
CAS RN: 67992-78-3
CAS Name: 2-[[(10S,13S,17S)-17-hydroxy-13-methyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-10-yl]methoxy]acetic acid
OPENEYE Name: 2-[[(10S,13S,17S)-17-hydroxy-13-methyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-10-yl]methoxy]acetic acid
IUPAC Name: 2-[[(10S,13S,17S)-17-hydroxy-13-methyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-10-yl]methoxy]acetic acid
SYSTEMATIC NAME: 2-[[(10S,13S,17S)-13-methyl-17-oxidanyl-3-oxidanylidene-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-10-yl]methoxy]ethanoic acid
MOLECULAR FORMULA: C21H30O5
MOLECULAR WEIGHT: 362.4599
SMILES: C[C@]12CCC3C(C1CC[C@@H]2O)CCC4=CC(=O)CC[C@]34COCC(=O)O
Structure:
CAS RN: 67990-56-1
CAS Name: formaldehyde; guanidine; urea; hydrochloride
OPENEYE Name: formaldehyde; guanidine; urea; hydrochloride
IUPAC Name: formaldehyde; guanidine; urea; hydrochloride
SYSTEMATIC NAME: guanidine; methanal; urea; hydrochloride
MOLECULAR FORMULA: C3H12ClN5O2
MOLECULAR WEIGHT: 185.61268
SMILES: C=O.C(=N)(N)N.C(=O)(N)N.Cl
Structure:
CAS RN: 67990-40-3
CAS Name: dimethyl-bis(prop-2-enyl)ammonium; 2-propenoic acid; 2-propenoic acid 2-hydroxypropyl ester; chloride
OPENEYE Name: acrylic acid; diallyl(dimethyl)ammonium; 2-hydroxypropyl prop-2-enoate; chloride
IUPAC Name: dimethyl-bis(prop-2-enyl)azanium; 2-hydroxypropyl prop-2-enoate; prop-2-enoic acid; chloride
SYSTEMATIC NAME: dimethyl-bis(prop-2-enyl)azanium; 2-oxidanylpropyl prop-2-enoate; prop-2-enoic acid; chloride
MOLECULAR FORMULA: C17H30ClNO5
MOLECULAR WEIGHT: 363.8768
SMILES: CC(COC(=O)C=C)O.C[N+](C)(CC=C)CC=C.C=CC(=O)O.[Cl-]
Structure:
CAS RN: 67989-89-3
CAS Name: copper; pentapotassium; hydron; N,N,N',N'-tetrakis(phosphonatomethyl)ethane-1,2-diamine
OPENEYE Name: copper; pentapotassium; hydron; N,N,N',N'-tetrakis(phosphonatomethyl)ethane-1,2-diamine
IUPAC Name: copper; pentapotassium; hydron; N,N,N',N'-tetrakis(phosphonatomethyl)ethane-1,2-diamine
SYSTEMATIC NAME: copper; pentapotassium; hydron; N,N,N',N'-tetrakis(phosphonatomethyl)ethane-1,2-diamine
MOLECULAR FORMULA: C6H13CuK5N2O12P4
MOLECULAR WEIGHT: 688.106164
SMILES: [H+].C(CN(CP(=O)([O-])[O-])CP(=O)([O-])[O-])N(CP(=O)([O-])[O-])CP(=O)([O-])[O-].[K+].[K+].[K+].[K+].[K+].[Cu+2]
Structure:
CAS RN: 67989-87-1
CAS Name: zinc 2-aminoethanol dichloride
OPENEYE Name: zinc 2-aminoethanol dichloride
IUPAC Name: zinc 2-aminoethanol dichloride
SYSTEMATIC NAME: zinc 2-azanylethanol dichloride
MOLECULAR FORMULA: C4H14Cl2N2O2Zn
MOLECULAR WEIGHT: 258.48116
SMILES: C(CO)N.C(CO)N.[Cl-].[Cl-].[Zn+2]
Structure:
CAS RN: 67989-74-6
CAS Name: 1,3-diisocyanato-2-methylbenzene; 2,4-diisocyanato-1-methylbenzene; hexanedioic acid; hexane-1,6-diol
OPENEYE Name: adipic acid; 1,3-diisocyanato-2-methyl-benzene; 2,4-diisocyanato-1-methyl-benzene; hexane-1,6-diol
IUPAC Name: 1,3-diisocyanato-2-methylbenzene; 2,4-diisocyanato-1-methylbenzene; hexanedioic acid; hexane-1,6-diol
SYSTEMATIC NAME: 1,3-diisocyanato-2-methyl-benzene; 2,4-diisocyanato-1-methyl-benzene; hexanedioic acid; hexane-1,6-diol
MOLECULAR FORMULA: C30H36N4O10
MOLECULAR WEIGHT: 612.62764
SMILES: CC1=C(C=C(C=C1)N=C=O)N=C=O.CC1=C(C=CC=C1N=C=O)N=C=O.C(CCCO)CCO.C(CCC(=O)O)CC(=O)O
Structure:
CAS RN: 67989-16-6
CAS Name: 1-butanol; 2-(2-hydroxyethoxy)ethanol; 2-methyloxirane; oxirane
OPENEYE Name: butan-1-ol; 2-(2-hydroxyethoxy)ethanol; 2-methyloxirane; oxirane
IUPAC Name: butan-1-ol; 2-(2-hydroxyethoxy)ethanol; 2-methyloxirane; oxirane
SYSTEMATIC NAME: butan-1-ol; 2-(2-hydroxyethyloxy)ethanol; 2-methyloxirane; oxirane
MOLECULAR FORMULA: C18H40O8
MOLECULAR WEIGHT: 384.5054
SMILES: CCCCO.CC1CO1.CC1CO1.C1CO1.C1CO1.C(COCCO)O
Structure:
CAS RN: 35919-04-1
CAS Name: benzoic acid; 2,2-dimethylpropane-1,3-diol; hexanedioic acid
OPENEYE Name: adipic acid; benzoic acid; 2,2-dimethylpropane-1,3-diol
IUPAC Name: benzoic acid; 2,2-dimethylpropane-1,3-diol; hexanedioic acid
SYSTEMATIC NAME: benzoic acid; 2,2-dimethylpropane-1,3-diol; hexanedioic acid
MOLECULAR FORMULA: C18H28O8
MOLECULAR WEIGHT: 372.41012
SMILES: CC(C)(CO)CO.C1=CC=C(C=C1)C(=O)O.C(CCC(=O)O)CC(=O)O
Structure:
CAS RN: 67989-13-3
CAS Name: benzoic acid; 2,2-dimethylpropane-1,3-diol; hexanedioic acid
OPENEYE Name: adipic acid; benzoic acid; 2,2-dimethylpropane-1,3-diol
IUPAC Name: benzoic acid; 2,2-dimethylpropane-1,3-diol; hexanedioic acid
SYSTEMATIC NAME: benzoic acid; 2,2-dimethylpropane-1,3-diol; hexanedioic acid
MOLECULAR FORMULA: C18H28O8
MOLECULAR WEIGHT: 372.41012
SMILES: CC(C)(CO)CO.C1=CC=C(C=C1)C(=O)O.C(CCC(=O)O)CC(=O)O
Structure:
CAS RN: 68389-68-4
CAS Name: benzoic acid; 2,2-dimethylpropane-1,3-diol; hexanedioic acid
OPENEYE Name: adipic acid; benzoic acid; 2,2-dimethylpropane-1,3-diol
IUPAC Name: benzoic acid; 2,2-dimethylpropane-1,3-diol; hexanedioic acid
SYSTEMATIC NAME: benzoic acid; 2,2-dimethylpropane-1,3-diol; hexanedioic acid
MOLECULAR FORMULA: C18H28O8
MOLECULAR WEIGHT: 372.41012
SMILES: CC(C)(CO)CO.C1=CC=C(C=C1)C(=O)O.C(CCC(=O)O)CC(=O)O
Structure:
CAS RN: 67970-32-5
CAS Name: 4-tert-butylphenol; formaldehyde; 2-methylphenol
OPENEYE Name: 4-tert-butylphenol; formaldehyde; o-cresol
IUPAC Name: 4-tert-butylphenol; formaldehyde; 2-methylphenol
SYSTEMATIC NAME: 4-tert-butylphenol; methanal; 2-methylphenol
MOLECULAR FORMULA: C18H24O3
MOLECULAR WEIGHT: 288.38136
SMILES: CC1=CC=CC=C1O.CC(C)(C)C1=CC=C(C=C1)O.C=O
Structure:
CAS RN: 67970-31-4
CAS Name: 2,3-bis(2-methylbutan-2-yl)-1-naphthalenesulfonic acid; cyclohexanamine
OPENEYE Name: 2,3-bis(1,1-dimethylpropyl)naphthalene-1-sulfonic acid; cyclohexanamine
IUPAC Name: 2,3-bis(2-methylbutan-2-yl)naphthalene-1-sulfonic acid; cyclohexanamine
SYSTEMATIC NAME: 2,3-bis(2-methylbutan-2-yl)naphthalene-1-sulfonic acid; cyclohexanamine
MOLECULAR FORMULA: C26H41NO3S
MOLECULAR WEIGHT: 447.67364
SMILES: CCC(C)(C)C1=CC2=CC=CC=C2C(=C1C(C)(C)CC)S(=O)(=O)O.C1CCC(CC1)N
Structure:
CAS RN: 67970-28-9
CAS Name: 1-butanamine; 2,3-dibutyl-1-naphthalenesulfonic acid
OPENEYE Name: butan-1-amine; 2,3-dibutylnaphthalene-1-sulfonic acid
IUPAC Name: butan-1-amine; 2,3-dibutylnaphthalene-1-sulfonic acid
SYSTEMATIC NAME: butan-1-amine; 2,3-dibutylnaphthalene-1-sulfonic acid
MOLECULAR FORMULA: C22H35NO3S
MOLECULAR WEIGHT: 393.5832
SMILES: CCCCC1=CC2=CC=CC=C2C(=C1CCCC)S(=O)(=O)O.CCCCN
Structure:
CAS RN: 67969-71-5
CAS Name: 2-methyloxirane; 2-methyl-2-propenoic acid 1-hydroxypropan-2-yl ester
OPENEYE Name: (2-hydroxy-1-methyl-ethyl) 2-methylprop-2-enoate; 2-methyloxirane
IUPAC Name: 1-hydroxypropan-2-yl 2-methylprop-2-enoate; 2-methyloxirane
SYSTEMATIC NAME: 2-methyloxirane; 1-oxidanylpropan-2-yl 2-methylprop-2-enoate
MOLECULAR FORMULA: C10H18O4
MOLECULAR WEIGHT: 202.24752
SMILES: CC1CO1.CC(CO)OC(=O)C(=C)C
Structure:
CAS RN: 67969-67-9
CAS Name: pentasodium; cobalt(2+); N,N,N',N'-tetrakis(phosphonatomethyl)ethane-1,2-diamine
OPENEYE Name: cobaltous pentasodium N,N,N',N'-tetrakis(phosphonatomethyl)ethane-1,2-diamine
IUPAC Name: pentasodium; cobalt(2+); N,N,N',N'-tetrakis(phosphonatomethyl)ethane-1,2-diamine
SYSTEMATIC NAME: pentasodium; cobalt(2+); N,N,N',N'-tetrakis(phosphonatomethyl)ethane-1,2-diamine
MOLECULAR FORMULA: C6H12CoN2Na5O12P4-
MOLECULAR WEIGHT: 601.942774
SMILES: C(CN(CP(=O)([O-])[O-])CP(=O)([O-])[O-])N(CP(=O)([O-])[O-])CP(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Co+2]
Structure:
CAS RN: 67968-63-2
CAS Name: dipotassium 9-sulfonatooctadecanoate
OPENEYE Name: dipotassium 9-sulfonatooctadecanoate
IUPAC Name: dipotassium 9-sulfonatooctadecanoate
SYSTEMATIC NAME: dipotassium 9-sulfonatooctadecanoate
MOLECULAR FORMULA: C18H34K2O5S
MOLECULAR WEIGHT: 440.72116
SMILES: CCCCCCCCCC(CCCCCCCC(=O)[O-])S(=O)(=O)[O-].[K+].[K+]
Structure:
CAS RN: 164324-42-9
CAS Name: diammonium 3-dodecyl-2-(2-sulfonatophenoxy)benzenesulfonate
OPENEYE Name: diammonium 3-dodecyl-2-(2-sulfonatophenoxy)benzenesulfonate
IUPAC Name: diazanium 3-dodecyl-2-(2-sulfonatophenoxy)benzenesulfonate
SYSTEMATIC NAME: diazanium 3-dodecyl-2-(2-sulfonatophenoxy)benzenesulfonate
MOLECULAR FORMULA: C24H40N2O7S2
MOLECULAR WEIGHT: 532.7136
SMILES: CCCCCCCCCCCCC1=C(C(=CC=C1)S(=O)(=O)[O-])OC2=CC=CC=C2S(=O)(=O)[O-].[NH4+].[NH4+]
Structure:
CAS RN: 67968-24-5
CAS Name: diammonium 3-dodecyl-2-(2-sulfonatophenoxy)benzenesulfonate
OPENEYE Name: diammonium 3-dodecyl-2-(2-sulfonatophenoxy)benzenesulfonate
IUPAC Name: diazanium 3-dodecyl-2-(2-sulfonatophenoxy)benzenesulfonate
SYSTEMATIC NAME: diazanium 3-dodecyl-2-(2-sulfonatophenoxy)benzenesulfonate
MOLECULAR FORMULA: C24H40N2O7S2
MOLECULAR WEIGHT: 532.7136
SMILES: CCCCCCCCCCCCC1=C(C(=CC=C1)S(=O)(=O)[O-])OC2=CC=CC=C2S(=O)(=O)[O-].[NH4+].[NH4+]
Structure:
CAS RN: 94346-41-5
CAS Name: diammonium 3-dodecyl-2-(2-sulfonatophenoxy)benzenesulfonate
OPENEYE Name: diammonium 3-dodecyl-2-(2-sulfonatophenoxy)benzenesulfonate
IUPAC Name: diazanium 3-dodecyl-2-(2-sulfonatophenoxy)benzenesulfonate
SYSTEMATIC NAME: diazanium 3-dodecyl-2-(2-sulfonatophenoxy)benzenesulfonate
MOLECULAR FORMULA: C24H40N2O7S2
MOLECULAR WEIGHT: 532.7136
SMILES: CCCCCCCCCCCCC1=C(C(=CC=C1)S(=O)(=O)[O-])OC2=CC=CC=C2S(=O)(=O)[O-].[NH4+].[NH4+]
Structure:
CAS RN: 67968-22-3
CAS Name: triammonium; hydron; nickel(2+); 1-phosphonato-N,N-bis(phosphonatomethyl)methanamine
OPENEYE Name: triammonium; nickelous; hydron; 1-phosphonato-N,N-bis(phosphonatomethyl)methanamine
IUPAC Name: triazanium; hydron; nickel(2+); 1-phosphonato-N,N-bis(phosphonatomethyl)methanamine
SYSTEMATIC NAME: triazanium; hydron; nickel(2+); 1-phosphonato-N,N-bis(phosphonatomethyl)methanamine
MOLECULAR FORMULA: C3H19N4NiO9P3
MOLECULAR WEIGHT: 406.819043
SMILES: [H+].C(N(CP(=O)([O-])[O-])CP(=O)([O-])[O-])P(=O)([O-])[O-].[NH4+].[NH4+].[NH4+].[Ni+2]
Structure:
CAS RN: 67953-81-5
CAS Name: dioxosilane; octadecanoic acid; trimethoxy-[3-(2-oxiranylmethoxy)propyl]silane
OPENEYE Name: dioxosilane; stearic acid; trimethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane
IUPAC Name: dioxosilane; octadecanoic acid; trimethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane
SYSTEMATIC NAME: bis(oxidanylidene)silane; octadecanoic acid; trimethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane
MOLECULAR FORMULA: C27H56O9Si2
MOLECULAR WEIGHT: 580.89914
SMILES: CCCCCCCCCCCCCCCCCC(=O)O.CO[Si](CCCOCC1CO1)(OC)OC.O=[Si]=O
Structure:
CAS RN: 67953-78-0
CAS Name: 4-dodecylphenol; ethane-1,2-diamine; formaldehyde
OPENEYE Name: 4-dodecylphenol; ethane-1,2-diamine; formaldehyde
IUPAC Name: 4-dodecylphenol; ethane-1,2-diamine; formaldehyde
SYSTEMATIC NAME: 4-dodecylphenol; ethane-1,2-diamine; methanal
MOLECULAR FORMULA: C21H40N2O2
MOLECULAR WEIGHT: 352.5545
SMILES: CCCCCCCCCCCCC1=CC=C(C=C1)O.C=O.C(CN)N
Structure:
CAS RN: 67953-74-6
CAS Name: 1-(butylthio)butane; trichloroiridium
OPENEYE Name: 1-butylsulfanylbutane; trichloroiridium
IUPAC Name: 1-butylsulfanylbutane; trichloroiridium
SYSTEMATIC NAME: 1-butylsulfanylbutane; tris(chloranyl)iridium
MOLECULAR FORMULA: C8H18Cl3IrS
MOLECULAR WEIGHT: 444.86952
SMILES: CCCCSCCCC.Cl[Ir](Cl)Cl
Structure:
CAS RN: 67953-73-5
CAS Name: iron(3+) tritetrafluoroborate
OPENEYE Name: ferric tritetrafluoroborate
IUPAC Name: iron(3+) tritetrafluoroborate
SYSTEMATIC NAME: iron(3+) tritetrafluoroborate
MOLECULAR FORMULA: B3F12Fe
MOLECULAR WEIGHT: 316.258838
SMILES: [B-](F)(F)(F)F.[B-](F)(F)(F)F.[B-](F)(F)(F)F.[Fe+3]
Structure:
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