CAS RN: 68555-98-6
CAS Name: 4-(2-methylbutan-2-yl)phenol; thiohypochlorous acid (chlorothio) ester
OPENEYE Name: chlorosulfanyl thiohypochlorite; 4-(1,1-dimethylpropyl)phenol
IUPAC Name: chlorosulfanyl thiohypochlorite; 4-(2-methylbutan-2-yl)phenol
SYSTEMATIC NAME: chloranylsulfanyl thiohypochlorite; 4-(2-methylbutan-2-yl)phenol
MOLECULAR FORMULA: C11H16Cl2OS2
MOLECULAR WEIGHT: 299.28014
SMILES: CCC(C)(C)C1=CC=C(C=C1)O.S(SCl)Cl
Structure:
CAS RN: 68555-91-9
CAS Name: 2-methyl-2-propenoic acid 2-[ethyl(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctylsulfonyl)amino]ethyl ester; 2-methyl-2-propenoic acid 2-[ethyl(1,1,2,2,3,3,4,4,4-nonafluorobutylsulfonyl)amino]ethyl ester; 2-methyl-2-propenoic acid 2-[ethyl(1,1,2,2
OPENEYE Name: 2-[ethyl(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctylsulfonyl)amino]ethyl 2-methylprop-2-enoate; 2-[ethyl(1,1,2,2,3,3,4,4,4-nonafluorobutylsulfonyl)amino]ethyl 2-methylprop-2-enoate; 2-[ethyl(1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoroheptylsu
IUPAC Name: 2-[ethyl(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctylsulfonyl)amino]ethyl 2-methylprop-2-enoate; 2-[ethyl(1,1,2,2,3,3,4,4,4-nonafluorobutylsulfonyl)amino]ethyl 2-methylprop-2-enoate; 2-[ethyl(1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoroheptylsu
SYSTEMATIC NAME: 2-[ethyl-[1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecakis(fluoranyl)octylsulfonyl]amino]ethyl 2-methylprop-2-enoate; 2-[ethyl-[1,1,2,2,3,3,4,4,4-nonakis(fluoranyl)butylsulfonyl]amino]ethyl 2-methylprop-2-enoate; 2-[ethyl-[1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pent
MOLECULAR FORMULA: C92H112F65N5O22S5
MOLECULAR WEIGHT: 3035.115188
SMILES: CCCCCCCCCCCCCCCCCCOC(=O)C(=C)C.CCN(CCOC(=O)C(=C)C)S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.CCN(CCOC(=O)C(=C)C)S(=O)(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.CCN(CCOC(=O)C(=C)C)S(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F
Structure:
CAS RN: 68555-90-8
CAS Name: 2-propenoic acid butyl ester; 2-propenoic acid 2-[1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctylsulfonyl(methyl)amino]ethyl ester; 2-propenoic acid 2-[methyl(1,1,2,2,3,3,4,4,4-nonafluorobutylsulfonyl)amino]ethyl ester; 2-propenoic acid 2-[methyl(1
OPENEYE Name: butyl prop-2-enoate; 2-[1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctylsulfonyl(methyl)amino]ethyl prop-2-enoate; 2-[methyl(1,1,2,2,3,3,4,4,4-nonafluorobutylsulfonyl)amino]ethyl prop-2-enoate; 2-[methyl(1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoro
IUPAC Name: butyl prop-2-enoate; 2-[1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctylsulfonyl(methyl)amino]ethyl prop-2-enoate; 2-[methyl(1,1,2,2,3,3,4,4,4-nonafluorobutylsulfonyl)amino]ethyl prop-2-enoate; 2-[methyl(1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoro
SYSTEMATIC NAME: butyl prop-2-enoate; 2-[1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecakis(fluoranyl)octylsulfonyl-methyl-amino]ethyl prop-2-enoate; 2-[methyl-[1,1,2,2,3,3,4,4,4-nonakis(fluoranyl)butylsulfonyl]amino]ethyl prop-2-enoate; 2-[methyl-[1,1,2,2,3,3,4,4,5,5,6,6,7,7
MOLECULAR FORMULA: C67H62F65N5O22S5
MOLECULAR WEIGHT: 2684.450688
SMILES: CCCCOC(=O)C=C.CN(CCOC(=O)C=C)S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.CN(CCOC(=O)C=C)S(=O)(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.CN(CCOC(=O)C=C)S(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.CN(CCOC(=O)C=C)S
Structure:
CAS RN: 68555-43-1
CAS Name: furan-2,5-dione; 2-(2-hydroxyethoxy)ethanol; 1-(2-hydroxypropoxy)-2-propanol
OPENEYE Name: furan-2,5-dione; 2-(2-hydroxyethoxy)ethanol; 1-(2-hydroxypropoxy)propan-2-ol
IUPAC Name: furan-2,5-dione; 2-(2-hydroxyethoxy)ethanol; 1-(2-hydroxypropoxy)propan-2-ol
SYSTEMATIC NAME: furan-2,5-dione; 2-(2-hydroxyethyloxy)ethanol; 1-(2-oxidanylpropoxy)propan-2-ol
MOLECULAR FORMULA: C14H26O9
MOLECULAR WEIGHT: 338.35084
SMILES: CC(COCC(C)O)O.C1=CC(=O)OC1=O.C(COCCO)O
Structure:
CAS RN: 68550-97-0
CAS Name: boric acid; 2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethanol
OPENEYE Name: boric acid; 2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethanol
IUPAC Name: boric acid; 2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethanol
SYSTEMATIC NAME: boric acid; 2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethanol
MOLECULAR FORMULA: C10H25BO8
MOLECULAR WEIGHT: 284.1117
SMILES: B(O)(O)O.CCOCCOCCOCCOCCO
Structure:
CAS RN: 68550-96-9
CAS Name: boric acid; 2-[2-(2-ethoxyethoxy)ethoxy]ethanol
OPENEYE Name: boric acid; 2-[2-(2-ethoxyethoxy)ethoxy]ethanol
IUPAC Name: boric acid; 2-[2-(2-ethoxyethoxy)ethoxy]ethanol
SYSTEMATIC NAME: boric acid; 2-[2-(2-ethoxyethoxy)ethoxy]ethanol
MOLECULAR FORMULA: C8H21BO7
MOLECULAR WEIGHT: 240.05914
SMILES: B(O)(O)O.CCOCCOCCOCCO
Structure:
CAS RN: 68541-81-1
CAS Name: (2R,3R,4R,5S)-hexane-1,2,3,4,5,6-hexol; 2-methyloxirane; oxirane; propane-1,2,3-triol
OPENEYE Name: glycerol; (2R,3R,4R,5S)-hexane-1,2,3,4,5,6-hexol; 2-methyloxirane; oxirane
IUPAC Name: (2R,3R,4R,5S)-hexane-1,2,3,4,5,6-hexol; 2-methyloxirane; oxirane; propane-1,2,3-triol
SYSTEMATIC NAME: (2R,3R,4R,5S)-hexane-1,2,3,4,5,6-hexol; 2-methyloxirane; oxirane; propane-1,2,3-triol
MOLECULAR FORMULA: C14H32O11
MOLECULAR WEIGHT: 376.39728
SMILES: CC1CO1.C1CO1.C([C@H]([C@H]([C@@H]([C@H](CO)O)O)O)O)O.C(C(CO)O)O
Structure:
CAS RN: 68541-69-5
CAS Name: tetrasodium; chromium(3+); hydron; 5-[(3-methyl-5-oxido-1-phenyl-4-pyrazolyl)azo]-4-oxidobenzene-1,3-disulfonate
OPENEYE Name: chromic; tetrasodium; hydron; 5-(3-methyl-5-oxido-1-phenyl-pyrazol-4-yl)azo-4-oxido-benzene-1,3-disulfonate
IUPAC Name: tetrasodium; chromium(3+); hydron; 5-[(3-methyl-5-oxido-1-phenylpyrazol-4-yl)diazenyl]-4-oxidobenzene-1,3-disulfonate
SYSTEMATIC NAME: tetrasodium; chromium(3+); hydron; 5-[(3-methyl-5-oxidanidyl-1-phenyl-pyrazol-4-yl)diazenyl]-4-oxidanidyl-benzene-1,3-disulfonate
MOLECULAR FORMULA: C32H21CrN8Na4O16S4
MOLECULAR WEIGHT: 1045.76832
SMILES: [H+].CC1=NN(C(=C1N=NC2=CC(=CC(=C2[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])[O-])C3=CC=CC=C3.CC1=NN(C(=C1N=NC2=CC(=CC(=C2[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])[O-])C3=CC=CC=C3.[Na+].[Na+].[Na+].[Na+].[Cr+3]
Structure:
CAS RN: 68541-65-1
CAS Name: 3-[2,3-bis(3-hydroxypropoxy)propoxy]-1-propanol; phosphoric acid
OPENEYE Name: 3-[2,3-bis(3-hydroxypropoxy)propoxy]propan-1-ol; phosphoric acid
IUPAC Name: 3-[2,3-bis(3-hydroxypropoxy)propoxy]propan-1-ol; phosphoric acid
SYSTEMATIC NAME: 3-[2,3-bis(3-oxidanylpropoxy)propoxy]propan-1-ol; phosphoric acid
MOLECULAR FORMULA: C12H29O10P
MOLECULAR WEIGHT: 364.326421
SMILES: C(CO)COCC(COCCCO)OCCCO.OP(=O)(O)O
Structure:
CAS RN: 68541-63-9
CAS Name: 2-methyl-2-propenoic acid butyl ester; 2-methyl-2-propenoic acid 2-hydroxypropyl ester; 2-propenamide; 2-propenoic acid; 2-propenoic acid 2-ethylhexyl ester; styrene
OPENEYE Name: acrylic acid; butyl 2-methylprop-2-enoate; 2-ethylhexyl prop-2-enoate; 2-hydroxypropyl 2-methylprop-2-enoate; prop-2-enamide; styrene
IUPAC Name: butyl 2-methylprop-2-enoate; 2-ethylhexyl prop-2-enoate; 2-hydroxypropyl 2-methylprop-2-enoate; prop-2-enamide; prop-2-enoic acid; styrene
SYSTEMATIC NAME: butyl 2-methylprop-2-enoate; ethenylbenzene; 2-ethylhexyl prop-2-enoate; 2-oxidanylpropyl 2-methylprop-2-enoate; prop-2-enamide; prop-2-enoic acid
MOLECULAR FORMULA: C40H63NO10
MOLECULAR WEIGHT: 717.92892
SMILES: CCCCC(CC)COC(=O)C=C.CCCCOC(=O)C(=C)C.CC(COC(=O)C(=C)C)O.C=CC1=CC=CC=C1.C=CC(=O)N.C=CC(=O)O
Structure:
CAS RN: 68541-58-2
CAS Name: 2-methyl-2-propenoic acid; 2-methyl-2-propenoic acid butyl ester; 2-methyl-2-propenoic acid 2-hydroxypropyl ester; 2-propenoic acid 2-ethylhexyl ester; styrene
OPENEYE Name: butyl 2-methylprop-2-enoate; 2-ethylhexyl prop-2-enoate; 2-hydroxypropyl 2-methylprop-2-enoate; 2-methylprop-2-enoic acid; styrene
IUPAC Name: butyl 2-methylprop-2-enoate; 2-ethylhexyl prop-2-enoate; 2-hydroxypropyl 2-methylprop-2-enoate; 2-methylprop-2-enoic acid; styrene
SYSTEMATIC NAME: butyl 2-methylprop-2-enoate; ethenylbenzene; 2-ethylhexyl prop-2-enoate; 2-methylprop-2-enoic acid; 2-oxidanylpropyl 2-methylprop-2-enoate
MOLECULAR FORMULA: C38H60O9
MOLECULAR WEIGHT: 660.8776
SMILES: CCCCC(CC)COC(=O)C=C.CCCCOC(=O)C(=C)C.CC(COC(=O)C(=C)C)O.CC(=C)C(=O)O.C=CC1=CC=CC=C1
Structure:
CAS RN: 68541-57-1
CAS Name: 2-methyl-2-propenoic acid butyl ester; 2-methyl-2-propenoic acid 2-hydroxypropyl ester; 2-propenoic acid; 2-propenoic acid butyl ester; styrene
OPENEYE Name: acrylic acid; butyl 2-methylprop-2-enoate; butyl prop-2-enoate; 2-hydroxypropyl 2-methylprop-2-enoate; styrene
IUPAC Name: butyl 2-methylprop-2-enoate; butyl prop-2-enoate; 2-hydroxypropyl 2-methylprop-2-enoate; prop-2-enoic acid; styrene
SYSTEMATIC NAME: butyl 2-methylprop-2-enoate; butyl prop-2-enoate; ethenylbenzene; 2-oxidanylpropyl 2-methylprop-2-enoate; prop-2-enoic acid
MOLECULAR FORMULA: C33H50O9
MOLECULAR WEIGHT: 590.7447
SMILES: CCCCOC(=O)C=C.CCCCOC(=O)C(=C)C.CC(COC(=O)C(=C)C)O.C=CC1=CC=CC=C1.C=CC(=O)O
Structure:
CAS RN: 68541-56-0
CAS Name: 2-bromophenol; 2-(chloromethyl)oxirane; formaldehyde
OPENEYE Name: 2-bromophenol; 2-(chloromethyl)oxirane; formaldehyde
IUPAC Name: 2-bromophenol; 2-(chloromethyl)oxirane; formaldehyde
SYSTEMATIC NAME: 2-bromanylphenol; 2-(chloromethyl)oxirane; methanal
MOLECULAR FORMULA: C10H12BrClO3
MOLECULAR WEIGHT: 295.55748
SMILES: C=O.C1C(O1)CCl.C1=CC=C(C(=C1)O)Br
Structure:
CAS RN: 68541-44-6
CAS Name: 3-mercaptopropanoic acid 6-methylheptyl ester; 2-methylenebutanoic acid; 2-methyl-2-propenoic acid; 2-methyl-2-propenoic acid methyl ester; styrene
OPENEYE Name: 2-methylenebutanoic acid; 6-methylheptyl 3-sulfanylpropanoate; methyl 2-methylprop-2-enoate; 2-methylprop-2-enoic acid; styrene
IUPAC Name: 6-methylheptyl 3-sulfanylpropanoate; 2-methylidenebutanoic acid; methyl 2-methylprop-2-enoate; 2-methylprop-2-enoic acid; styrene
SYSTEMATIC NAME: ethenylbenzene; 6-methylheptyl 3-sulfanylpropanoate; 2-methylidenebutanoic acid; methyl 2-methylprop-2-enoate; 2-methylprop-2-enoic acid
MOLECULAR FORMULA: C33H52O8S
MOLECULAR WEIGHT: 608.82618
SMILES: CCC(=C)C(=O)O.CC(C)CCCCCOC(=O)CCS.CC(=C)C(=O)O.CC(=C)C(=O)OC.C=CC1=CC=CC=C1
Structure:
CAS RN: 68541-30-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C26H28O9
MOLECULAR WEIGHT: 484.49512
SMILES: C1C=CC2C1C3CC2C=C3.C1=CC=C2C(=C1)C(=O)OC2=O.C1=CC(=O)OC1=O.C(COCCO)O
Structure:
CAS RN: 68540-98-7
CAS Name: N-[3-[2-(2-cyanoethoxy)ethylamino]-4-methoxyphenyl]propanamide
OPENEYE Name: N-[3-[2-(2-cyanoethoxy)ethylamino]-4-methoxy-phenyl]propanamide
IUPAC Name: N-[3-[2-(2-cyanoethoxy)ethylamino]-4-methoxyphenyl]propanamide
SYSTEMATIC NAME: N-[3-[2-(2-cyanoethoxy)ethylamino]-4-methoxy-phenyl]propanamide
MOLECULAR FORMULA: C15H21N3O3
MOLECULAR WEIGHT: 291.34554
SMILES: CCC(=O)NC1=CC(=C(C=C1)OC)NCCOCCC#N
Structure:
CAS RN: 68540-71-6
CAS Name: formaldehyde; 2-hydroxybenzoic acid; 2-methylphenol; 2-nonylphenol
OPENEYE Name: formaldehyde; 2-hydroxybenzoic acid; 2-nonylphenol; o-cresol
IUPAC Name: formaldehyde; 2-hydroxybenzoic acid; 2-methylphenol; 2-nonylphenol
SYSTEMATIC NAME: methanal; 2-methylphenol; 2-nonylphenol; 2-oxidanylbenzoic acid
MOLECULAR FORMULA: C30H40O6
MOLECULAR WEIGHT: 496.635
SMILES: CCCCCCCCCC1=CC=CC=C1O.CC1=CC=CC=C1O.C=O.C1=CC=C(C(=C1)C(=O)O)O
Structure:
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