CAS RN: 4170-71-2
CAS Name: tert-butylsulfinylbenzene
OPENEYE Name: tert-butylsulfinylbenzene
IUPAC Name: tert-butylsulfinylbenzene
SYSTEMATIC NAME: tert-butylsulfinylbenzene
MOLECULAR FORMULA: C10H14OS
MOLECULAR WEIGHT: 182.28256
SMILES: CC(C)(C)S(=O)C1=CC=CC=C1
Structure:
CAS RN: 4170-46-1
CAS Name: trichloro(propan-2-yl)silane
OPENEYE Name: trichloro(isopropyl)silane
IUPAC Name: trichloro(propan-2-yl)silane
SYSTEMATIC NAME: tris(chloranyl)-propan-2-yl-silane
MOLECULAR FORMULA: C3H7Cl3Si
MOLECULAR WEIGHT: 177.53218
SMILES: CC(C)[Si](Cl)(Cl)Cl
Structure:
CAS RN: 4165-98-4
CAS Name: 3-propylpentanedioic acid
OPENEYE Name: 3-propylpentanedioic acid
IUPAC Name: 3-propylpentanedioic acid
SYSTEMATIC NAME: 3-propylpentanedioic acid
MOLECULAR FORMULA: C8H14O4
MOLECULAR WEIGHT: 174.19436
SMILES: CCCC(CC(=O)O)CC(=O)O
Structure:
CAS RN: 4164-29-8
CAS Name: N,N-dipropylnitramide
OPENEYE Name: N,N-dipropylnitramide
IUPAC Name: N,N-dipropylnitramide
SYSTEMATIC NAME: N,N-dipropylnitramide
MOLECULAR FORMULA: C6H14N2O2
MOLECULAR WEIGHT: 146.18756
SMILES: CCCN(CCC)[N+](=O)[O-]
Structure:
CAS RN: 4161-65-3
CAS Name: 2,4-dimethylpenta-1,4-diene
OPENEYE Name: 2,4-dimethylpenta-1,4-diene
IUPAC Name: 2,4-dimethylpenta-1,4-diene
SYSTEMATIC NAME: 2,4-dimethylpenta-1,4-diene
MOLECULAR FORMULA: C7H12
MOLECULAR WEIGHT: 96.17018
SMILES: CC(=C)CC(=C)C
Structure:
CAS RN: 102107-90-4
CAS Name: 2-(ethyldisulfanyl)-2-methylpropane
OPENEYE Name: 2-(ethyldisulfanyl)-2-methyl-propane
IUPAC Name: 2-(ethyldisulfanyl)-2-methylpropane
SYSTEMATIC NAME: 2-(ethyldisulfanyl)-2-methyl-propane
MOLECULAR FORMULA: C6H14S2
MOLECULAR WEIGHT: 150.30536
SMILES: CCSSC(C)(C)C
Structure:
CAS RN: 4151-69-3
CAS Name: 2-(ethyldisulfanyl)-2-methylpropane
OPENEYE Name: 2-(ethyldisulfanyl)-2-methyl-propane
IUPAC Name: 2-(ethyldisulfanyl)-2-methylpropane
SYSTEMATIC NAME: 2-(ethyldisulfanyl)-2-methyl-propane
MOLECULAR FORMULA: C6H14S2
MOLECULAR WEIGHT: 150.30536
SMILES: CCSSC(C)(C)C
Structure:
CAS RN: 4150-37-2
CAS Name: 4-ethyl-N,N-dimethylaniline
OPENEYE Name: 4-ethyl-N,N-dimethyl-aniline
IUPAC Name: 4-ethyl-N,N-dimethylaniline
SYSTEMATIC NAME: 4-ethyl-N,N-dimethyl-aniline
MOLECULAR FORMULA: C10H15N
MOLECULAR WEIGHT: 149.2328
SMILES: CCC1=CC=C(C=C1)N(C)C
Structure:
CAS RN: 4147-89-1
CAS Name: N,N-bis(trimethylsilyl)aniline
OPENEYE Name: N,N-bis(trimethylsilyl)aniline
IUPAC Name: N,N-bis(trimethylsilyl)aniline
SYSTEMATIC NAME: N,N-bis(trimethylsilyl)aniline
MOLECULAR FORMULA: C12H23NSi2
MOLECULAR WEIGHT: 237.48872
SMILES: C[Si](C)(C)N(C1=CC=CC=C1)[Si](C)(C)C
Structure:
CAS RN: 4146-24-1
CAS Name: 6-chloro-2-methyl-1,3-benzothiazole
OPENEYE Name: 6-chloro-2-methyl-1,3-benzothiazole
IUPAC Name: 6-chloro-2-methyl-1,3-benzothiazole
SYSTEMATIC NAME: 6-chloranyl-2-methyl-1,3-benzothiazole
MOLECULAR FORMULA: C8H6ClNS
MOLECULAR WEIGHT: 183.65794
SMILES: CC1=NC2=C(S1)C=C(C=C2)Cl
Structure:
CAS RN: 4141-67-7
CAS Name: 1,2,3,4,5-pentaethylpentaphospholane
OPENEYE Name: 1,2,3,4,5-pentaethylpentaphospholane
IUPAC Name: 1,2,3,4,5-pentaethylpentaphospholane
SYSTEMATIC NAME: 1,2,3,4,5-pentaethyl-1,2,3,4,5-pentaphospholane
MOLECULAR FORMULA: C10H25P5
MOLECULAR WEIGHT: 300.174305
SMILES: CCP1P(P(P(P1CC)CC)CC)CC
Structure:
CAS RN: 4141-48-4
CAS Name: [phenyl(prop-2-enyl)phosphoryl]benzene
OPENEYE Name: [allyl(phenyl)phosphoryl]benzene
IUPAC Name: [phenyl(prop-2-enyl)phosphoryl]benzene
SYSTEMATIC NAME: [phenyl(prop-2-enyl)phosphoryl]benzene
MOLECULAR FORMULA: C15H15OP
MOLECULAR WEIGHT: 242.252761
SMILES: C=CCP(=O)(C1=CC=CC=C1)C2=CC=CC=C2
Structure:
CAS RN: 4139-78-0
CAS Name: N,N-dimethyl-4-propan-2-ylaniline
OPENEYE Name: 4-isopropyl-N,N-dimethyl-aniline
IUPAC Name: N,N-dimethyl-4-propan-2-ylaniline
SYSTEMATIC NAME: N,N-dimethyl-4-propan-2-yl-aniline
MOLECULAR FORMULA: C11H17N
MOLECULAR WEIGHT: 163.25938
SMILES: CC(C)C1=CC=C(C=C1)N(C)C
Structure:
CAS RN: 4136-26-9
CAS Name: 5,6-dimethoxy-3,3-dimethyl-2H-inden-1-one
OPENEYE Name: 5,6-dimethoxy-3,3-dimethyl-indan-1-one
IUPAC Name: 5,6-dimethoxy-3,3-dimethyl-2H-inden-1-one
SYSTEMATIC NAME: 5,6-dimethoxy-3,3-dimethyl-2H-inden-1-one
MOLECULAR FORMULA: C13H16O3
MOLECULAR WEIGHT: 220.26434
SMILES: CC1(CC(=O)C2=CC(=C(C=C21)OC)OC)C
Structure:
CAS RN: 4135-93-7
CAS Name: 2,5-dimethyltetrazole
OPENEYE Name: 2,5-dimethyltetrazole
IUPAC Name: 2,5-dimethyltetrazole
SYSTEMATIC NAME: 2,5-dimethyl-1,2,3,4-tetrazole
MOLECULAR FORMULA: C3H6N4
MOLECULAR WEIGHT: 98.10654
SMILES: CC1=NN(N=N1)C
Structure:
CAS RN: 4132-77-8
CAS Name: 1,2-dimethyl-4-propan-2-ylbenzene
OPENEYE Name: 4-isopropyl-1,2-dimethyl-benzene
IUPAC Name: 1,2-dimethyl-4-propan-2-ylbenzene
SYSTEMATIC NAME: 1,2-dimethyl-4-propan-2-yl-benzene
MOLECULAR FORMULA: C11H16
MOLECULAR WEIGHT: 148.24474
SMILES: CC1=C(C=C(C=C1)C(C)C)C
Structure:
CAS RN: 4131-47-9
CAS Name: trimethyl(2-phenylethynyl)germane
OPENEYE Name: trimethyl(2-phenylethynyl)germane
IUPAC Name: trimethyl(2-phenylethynyl)germane
SYSTEMATIC NAME: trimethyl(2-phenylethynyl)germane
MOLECULAR FORMULA: C11H14Ge
MOLECULAR WEIGHT: 218.86886
SMILES: C[Ge](C)(C)C#CC1=CC=CC=C1
Structure:
CAS RN: 4127-45-1
CAS Name: 1,1,2-trimethylcyclopropane
OPENEYE Name: 1,1,2-trimethylcyclopropane
IUPAC Name: 1,1,2-trimethylcyclopropane
SYSTEMATIC NAME: 1,1,2-trimethylcyclopropane
MOLECULAR FORMULA: C6H12
MOLECULAR WEIGHT: 84.15948
SMILES: CC1CC1(C)C
Structure:
CAS RN: 4125-18-2
CAS Name: 5,5-dimethylcyclopenta-1,3-diene
OPENEYE Name: 5,5-dimethylcyclopenta-1,3-diene
IUPAC Name: 5,5-dimethylcyclopenta-1,3-diene
SYSTEMATIC NAME: 5,5-dimethylcyclopenta-1,3-diene
MOLECULAR FORMULA: C7H10
MOLECULAR WEIGHT: 94.1543
SMILES: CC1(C=CC=C1)C
Structure:
CAS RN: 4122-45-6
CAS Name: 3-nitro-2-oxido-4,5-dihydroisoxazol-2-ium
OPENEYE Name: 3-nitro-2-oxido-4,5-dihydroisoxazol-2-ium
IUPAC Name: 3-nitro-2-oxido-4,5-dihydro-1,2-oxazol-2-ium
SYSTEMATIC NAME: 3-nitro-2-oxidanidyl-4,5-dihydro-1,2-oxazol-2-ium
MOLECULAR FORMULA: C3H4N2O4
MOLECULAR WEIGHT: 132.07486
SMILES: C1CO[N+](=C1[N+](=O)[O-])[O-]
Structure:
CAS RN: 4120-02-9
CAS Name: ethenimine
OPENEYE Name: ethenimine
IUPAC Name: ethenimine
SYSTEMATIC NAME: ethenimine
MOLECULAR FORMULA: C2H3N
MOLECULAR WEIGHT: 41.05192
SMILES: C=C=N
Structure:
CAS RN: 4119-41-9
CAS Name: 3-iodopropylbenzene
OPENEYE Name: 3-iodopropylbenzene
IUPAC Name: 3-iodopropylbenzene
SYSTEMATIC NAME: 3-iodanylpropylbenzene
MOLECULAR FORMULA: C9H11I
MOLECULAR WEIGHT: 246.08811
SMILES: C1=CC=C(C=C1)CCCI
Structure:
CAS RN: 4114-21-0
CAS Name: 2,5-dimethyl-1H-1,2,4-triazol-3-one
OPENEYE Name: 2,5-dimethyl-1H-1,2,4-triazol-3-one
IUPAC Name: 2,5-dimethyl-1H-1,2,4-triazol-3-one
SYSTEMATIC NAME: 2,5-dimethyl-1H-1,2,4-triazol-3-one
MOLECULAR FORMULA: C4H7N3O
MOLECULAR WEIGHT: 113.11788
SMILES: CC1=NC(=O)N(N1)C
Structure:
CAS RN: 4113-72-8
CAS Name: 1-azido-3-methylbenzene
OPENEYE Name: 1-azido-3-methyl-benzene
IUPAC Name: 1-azido-3-methylbenzene
SYSTEMATIC NAME: 1-azido-3-methyl-benzene
MOLECULAR FORMULA: C7H7N3
MOLECULAR WEIGHT: 133.15058
SMILES: CC1=CC(=CC=C1)N=[N+]=[N-]
Structure:
CAS RN: 4112-23-6
CAS Name: dimethyl(methylene)silane
OPENEYE Name: dimethyl(methylene)silane
IUPAC Name: dimethyl(methylidene)silane
SYSTEMATIC NAME: dimethyl(methylidene)silane
MOLECULAR FORMULA: C3H8Si
MOLECULAR WEIGHT: 72.18112
SMILES: C[Si](=C)C
Structure:
CAS RN: 4110-44-5
CAS Name: 3,3-dimethyloctane
OPENEYE Name: 3,3-dimethyloctane
IUPAC Name: 3,3-dimethyloctane
SYSTEMATIC NAME: 3,3-dimethyloctane
MOLECULAR FORMULA: C10H22
MOLECULAR WEIGHT: 142.28168
SMILES: CCCCCC(C)(C)CC
Structure:
CAS RN: 4098-98-0
CAS Name: tetrakis(trimethylsilyl)silane
OPENEYE Name: tetrakis(trimethylsilyl)silane
IUPAC Name: tetrakis(trimethylsilyl)silane
SYSTEMATIC NAME: tetrakis(trimethylsilyl)silane
MOLECULAR FORMULA: C12H36Si5
MOLECULAR WEIGHT: 320.84174
SMILES: C[Si](C)(C)[Si]([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C
Structure:
CAS RN: 4096-95-1
CAS Name: bicyclo[3.2.1]octa-3,6-diene
OPENEYE Name: bicyclo[3.2.1]octa-3,6-diene
IUPAC Name: bicyclo[3.2.1]octa-3,6-diene
SYSTEMATIC NAME: bicyclo[3.2.1]octa-3,6-diene
MOLECULAR FORMULA: C8H10
MOLECULAR WEIGHT: 106.165
SMILES: C1C=CC2CC1C=C2
Structure:
CAS RN: 4095-22-1
CAS Name: 2-propan-2-ylthiophene
OPENEYE Name: 2-isopropylthiophene
IUPAC Name: 2-propan-2-ylthiophene
SYSTEMATIC NAME: 2-propan-2-ylthiophene
MOLECULAR FORMULA: C7H10S
MOLECULAR WEIGHT: 126.2193
SMILES: CC(C)C1=CC=CS1
Structure:
CAS RN: 4095-06-1
CAS Name: 3-methylenecyclopropene
OPENEYE Name: 3-methylenecyclopropene
IUPAC Name: 3-methylidenecyclopropene
SYSTEMATIC NAME: 3-methylidenecyclopropene
MOLECULAR FORMULA: C4H4
MOLECULAR WEIGHT: 52.07456
SMILES: C=C1C=C1
Structure:
CAS RN: 4088-63-5
CAS Name: 1-methyl-2-pyridinimine
OPENEYE Name: 1-methylpyridin-2-imine
IUPAC Name: 1-methylpyridin-2-imine
SYSTEMATIC NAME: 1-methylpyridin-2-imine
MOLECULAR FORMULA: C6H8N2
MOLECULAR WEIGHT: 108.14112
SMILES: CN1C=CC=CC1=N
Structure:
CAS RN: 4087-51-8
CAS Name: 6-methylspiro[2.4]hepta-4,6-diene
OPENEYE Name: 6-methylspiro[2.4]hepta-4,6-diene
IUPAC Name: 6-methylspiro[2.4]hepta-4,6-diene
SYSTEMATIC NAME: 6-methylspiro[2.4]hepta-4,6-diene
MOLECULAR FORMULA: C8H10
MOLECULAR WEIGHT: 106.165
SMILES: CC1=CC2(CC2)C=C1
Structure:
CAS RN: 4087-50-7
CAS Name: 1,2,3,4,5,5-hexamethylcyclopenta-1,3-diene
OPENEYE Name: 1,2,3,4,5,5-hexamethylcyclopenta-1,3-diene
IUPAC Name: 1,2,3,4,5,5-hexamethylcyclopenta-1,3-diene
SYSTEMATIC NAME: 1,2,3,4,5,5-hexamethylcyclopenta-1,3-diene
MOLECULAR FORMULA: C11H18
MOLECULAR WEIGHT: 150.26062
SMILES: CC1=C(C(C(=C1C)C)(C)C)C
Structure:
CAS RN: 4076-36-2
CAS Name: 5-methyl-2H-tetrazole
OPENEYE Name: 5-methyl-2H-tetrazole
IUPAC Name: 5-methyl-2H-tetrazole
SYSTEMATIC NAME: 5-methyl-2H-1,2,3,4-tetrazole
MOLECULAR FORMULA: C2H4N4
MOLECULAR WEIGHT: 84.07996
SMILES: CC1=NNN=N1
Structure:
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