2-chloro-4-fluoro-1-propan-2-ylbenzene;4-chloro-2-fluoro-1-propan-2-ylbenzene;2-chloro-1-propan-2-yl-4-(trifluoromethyl)benzene;4-chloro-1-propan-2-yl-2-(trifluoromethyl)benzene;cumene;2,4-dichloro-1-propan-2-ylbenzene;2,4-difluoro-1-propan-2-ylbenzene;2-fluoro-4-methoxy-1-propan-2-ylbenzene;4-fluoro-2-methyl-1-propan-2-ylbenzene;5-fluoro-2-propan-2-ylbenzamide;2-fluoro-1-propan-2-yl-4-(trifluoromethyl)benzene;4-fluoro-1-propan-2-yl-2-(trifluoromethyl)benzene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;bis(1-methyl-4-propan-2-ylbenzene);1-propan-2-yl-2,4-bis(trifluoromethyl)benzene;1-propan-2-ylnaphthalene;4-propan-2-ylphenol;5-propan-2-yl-1,2,3,4-tetrahydronaphthalene;1-propan-2-yl-4-(trifluoromethyl)benzene

C211H251Cl6F30NO3 — CID 161110886

IUPAC2-chloro-4-fluoro-1-propan-2-ylbenzene;4-chloro-2-fluoro-1-propan-2-ylbenzene;2-chloro-1-propan-2-yl-4-(trifluoromethyl)benzene;4-chloro-1-propan-2-yl-2-(trifluoromethyl)benzene;cumene;2,4-dichloro-1-propan-2-ylbenzene;2,4-difluoro-1-propan-2-ylbenzene;2-fluoro-4-methoxy-1-propan-2-ylbenzene;4-fluoro-2-methyl-1-propan-2-ylbenzene;5-fluoro-2-propan-2-ylbenzamide;2-fluoro-1-propan-2-yl-4-(trifluoromethyl)benzene;4-fluoro-1-propan-2-yl-2-(trifluoromethyl)benzene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;bis(1-methyl-4-propan-2-ylbenzene);1-propan-2-yl-2,4-bis(trifluoromethyl)benzene;1-propan-2-ylnaphthalene;4-propan-2-ylphenol;5-propan-2-yl-1,2,3,4-tetrahydronaphthalene;1-propan-2-yl-4-(trifluoromethyl)benzene
SMILESCC(C)c1ccc(C(F)(F)F)cc1.CC(C)c1ccc(C(F)(F)F)cc1C(F)(F)F.CC(C)c1ccc(C(F)(F)F)cc1Cl.CC(C)c1ccc(C(F)(F)F)cc1F.CC(C)c1ccc(Cl)cc1C(F)(F)F.CC(C)c1ccc(Cl)cc1Cl.CC(C)c1ccc(Cl)cc1F.CC(C)c1ccc(F)cc1C(F)(F)F.CC(C)c1ccc(F)cc1C(N)=O.CC(C)c1ccc(F)cc1Cl.CC(C)c1ccc(F)cc1F.CC(C)c1ccc(O)cc1.CC(C)c1cccc2c1CCCC2.CC(C)c1cccc2ccccc12.CC(C)c1ccccc1.COc1ccc(C(C)C)c(F)c1.Cc1cc(F)ccc1C(C)C.Cc1ccc(C(C)C)cc1.Cc1ccc(C(C)C)cc1.Cc1cccc(C(C)C)c1.Cc1ccccc1C(C)C
InChIInChI=1S/C13H18.C13H14.C11H10F6.2C10H10ClF3.2C10H10F4.C10H11F3.C10H12FNO.C10H13FO.C10H13F.4C10H14.C9H10Cl2.2C9H10ClF.C9H10F2.C9H12O.C9H12/c2*1-10(2)12-9-5-7-11-6-3-4-8-13(11)12;1-6(2)8-4-3-7(10(12,13)14)5-9(8)11(15,16)17;1-6(2)8-4-3-7(11)5-9(8)10(12,13)14;1-6(2)8-4-3-7(5-9(8)11)10(12,13)14;1-6(2)8-4-3-7(11)5-9(8)10(12,13)14;1-6(2)8-4-3-7(5-9(8)11)10(12,13)14;1-7(2)8-3-5-9(6-4-8)10(11,12)13;1-6(2)8-4-3-7(11)5-9(8)10(12)13;1-7(2)9-5-4-8(12-3)6-10(9)11;1-7(2)10-5-4-9(11)6-8(10)3;2*1-8(2)10-6-4-9(3)5-7-10;1-8(2)10-6-4-5-9(3)7-10;1-8(2)10-7-5-4-6-9(10)3;1-6(2)8-4-3-7(10)5-9(8)11;1-6(2)8-4-3-7(11)5-9(8)10;2*1-6(2)8-4-3-7(10)5-9(8)11;1-7(2)8-3-5-9(10)6-4-8;1-8(2)9-6-4-3-5-7-9/h5,7,9-10H,3-4,6,8H2,1-2H3;3-10H,1-2H3;3-6H,1-2H3;4*3-6H,1-2H3;3-7H,1-2H3;3-6H,1-2H3,(H2,12,13);4-7H,1-3H3;4-7H,1-3H3;4*4-8H,1-3H3;4*3-6H,1-2H3;3-7,10H,1-2H3;3-8H,1-2H3
InChIKeyUJRDBUZKBBHXQK-UHFFFAOYSA-N
MW3631.99 g/mol
LogP73.70
Rot. Bonds23

About 2-chloro-4-fluoro-1-propan-2-ylbenzene;4-chloro-2-fluoro-1-propan-2-ylbenzene;2-chloro-1-propan-2-yl-4-(trifluoromethyl)benzene;4-chloro-1-propan-2-yl-2-(trifluoromethyl)benzene;cumene;2,4-dichloro-1-propan-2-ylbenzene;2,4-difluoro-1-propan-2-ylbenzene;2-fluoro-4-methoxy-1-propan-2-ylbenzene;4-fluoro-2-methyl-1-propan-2-ylbenzene;5-fluoro-2-propan-2-ylbenzamide;2-fluoro-1-propan-2-yl-4-(trifluoromethyl)benzene;4-fluoro-1-propan-2-yl-2-(trifluoromethyl)benzene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;bis(1-methyl-4-propan-2-ylbenzene);1-propan-2-yl-2,4-bis(trifluoromethyl)benzene;1-propan-2-ylnaphthalene;4-propan-2-ylphenol;5-propan-2-yl-1,2,3,4-tetrahydronaphthalene;1-propan-2-yl-4-(trifluoromethyl)benzene

2-chloro-4-fluoro-1-propan-2-ylbenzene;4-chloro-2-fluoro-1-propan-2-ylbenzene;2-chloro-1-propan-2-yl-4-(trifluoromethyl)benzene;4-chloro-1-propan-2-yl-2-(trifluoromethyl)benzene;cumene;2,4-dichloro-1-propan-2-ylbenzene;2,4-difluoro-1-propan-2-ylbenzene;2-fluoro-4-methoxy-1-propan-2-ylbenzene;4-fluoro-2-methyl-1-propan-2-ylbenzene;5-fluoro-2-propan-2-ylbenzamide;2-fluoro-1-propan-2-yl-4-(trifluoromethyl)benzene;4-fluoro-1-propan-2-yl-2-(trifluoromethyl)benzene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;bis(1-methyl-4-propan-2-ylbenzene);1-propan-2-yl-2,4-bis(trifluoromethyl)benzene;1-propan-2-ylnaphthalene;4-propan-2-ylphenol;5-propan-2-yl-1,2,3,4-tetrahydronaphthalene;1-propan-2-yl-4-(trifluoromethyl)benzene (PubChem CID 161110886) has the molecular formula C211H251Cl6F30NO3 and a molecular weight of 3631.99 g/mol. Its IUPAC name is 2-chloro-4-fluoro-1-propan-2-ylbenzene;4-chloro-2-fluoro-1-propan-2-ylbenzene;2-chloro-1-propan-2-yl-4-(trifluoromethyl)benzene;4-chloro-1-propan-2-yl-2-(trifluoromethyl)benzene;cumene;2,4-dichloro-1-propan-2-ylbenzene;2,4-difluoro-1-propan-2-ylbenzene;2-fluoro-4-methoxy-1-propan-2-ylbenzene;4-fluoro-2-methyl-1-propan-2-ylbenzene;5-fluoro-2-propan-2-ylbenzamide;2-fluoro-1-propan-2-yl-4-(trifluoromethyl)benzene;4-fluoro-1-propan-2-yl-2-(trifluoromethyl)benzene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;bis(1-methyl-4-propan-2-ylbenzene);1-propan-2-yl-2,4-bis(trifluoromethyl)benzene;1-propan-2-ylnaphthalene;4-propan-2-ylphenol;5-propan-2-yl-1,2,3,4-tetrahydronaphthalene;1-propan-2-yl-4-(trifluoromethyl)benzene.

Molecular Properties

Compound Name2-chloro-4-fluoro-1-propan-2-ylbenzene;4-chloro-2-fluoro-1-propan-2-ylbenzene;2-chloro-1-propan-2-yl-4-(trifluoromethyl)benzene;4-chloro-1-propan-2-yl-2-(trifluoromethyl)benzene;cumene;2,4-dichloro-1-propan-2-ylbenzene;2,4-difluoro-1-propan-2-ylbenzene;2-fluoro-4-methoxy-1-propan-2-ylbenzene;4-fluoro-2-methyl-1-propan-2-ylbenzene;5-fluoro-2-propan-2-ylbenzamide;2-fluoro-1-propan-2-yl-4-(trifluoromethyl)benzene;4-fluoro-1-propan-2-yl-2-(trifluoromethyl)benzene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;bis(1-methyl-4-propan-2-ylbenzene);1-propan-2-yl-2,4-bis(trifluoromethyl)benzene;1-propan-2-ylnaphthalene;4-propan-2-ylphenol;5-propan-2-yl-1,2,3,4-tetrahydronaphthalene;1-propan-2-yl-4-(trifluoromethyl)benzene
PubChem CID161110886
Molecular FormulaC211H251Cl6F30NO3
Molecular Weight3631.99 g/mol
Exact Mass3626.72
IUPAC Name2-chloro-4-fluoro-1-propan-2-ylbenzene;4-chloro-2-fluoro-1-propan-2-ylbenzene;2-chloro-1-propan-2-yl-4-(trifluoromethyl)benzene;4-chloro-1-propan-2-yl-2-(trifluoromethyl)benzene;cumene;2,4-dichloro-1-propan-2-ylbenzene;2,4-difluoro-1-propan-2-ylbenzene;2-fluoro-4-methoxy-1-propan-2-ylbenzene;4-fluoro-2-methyl-1-propan-2-ylbenzene;5-fluoro-2-propan-2-ylbenzamide;2-fluoro-1-propan-2-yl-4-(trifluoromethyl)benzene;4-fluoro-1-propan-2-yl-2-(trifluoromethyl)benzene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;bis(1-methyl-4-propan-2-ylbenzene);1-propan-2-yl-2,4-bis(trifluoromethyl)benzene;1-propan-2-ylnaphthalene;4-propan-2-ylphenol;5-propan-2-yl-1,2,3,4-tetrahydronaphthalene;1-propan-2-yl-4-(trifluoromethyl)benzene
SMILESCC(C)c1ccc(C(F)(F)F)cc1.CC(C)c1ccc(C(F)(F)F)cc1C(F)(F)F.CC(C)c1ccc(C(F)(F)F)cc1Cl.CC(C)c1ccc(C(F)(F)F)cc1F.CC(C)c1ccc(Cl)cc1C(F)(F)F.CC(C)c1ccc(Cl)cc1Cl.CC(C)c1ccc(Cl)cc1F.CC(C)c1ccc(F)cc1C(F)(F)F.CC(C)c1ccc(F)cc1C(N)=O.CC(C)c1ccc(F)cc1Cl.CC(C)c1ccc(F)cc1F.CC(C)c1ccc(O)cc1.CC(C)c1cccc2c1CCCC2.CC(C)c1cccc2ccccc12.CC(C)c1ccccc1.COc1ccc(C(C)C)c(F)c1.Cc1cc(F)ccc1C(C)C.Cc1ccc(C(C)C)cc1.Cc1ccc(C(C)C)cc1.Cc1cccc(C(C)C)c1.Cc1ccccc1C(C)C
InChIInChI=1S/C13H18.C13H14.C11H10F6.2C10H10ClF3.2C10H10F4.C10H11F3.C10H12FNO.C10H13FO.C10H13F.4C10H14.C9H10Cl2.2C9H10ClF.C9H10F2.C9H12O.C9H12/c2*1-10(2)12-9-5-7-11-6-3-4-8-13(11)12;1-6(2)8-4-3-7(10(12,13)14)5-9(8)11(15,16)17;1-6(2)8-4-3-7(11)5-9(8)10(12,13)14;1-6(2)8-4-3-7(5-9(8)11)10(12,13)14;1-6(2)8-4-3-7(11)5-9(8)10(12,13)14;1-6(2)8-4-3-7(5-9(8)11)10(12,13)14;1-7(2)8-3-5-9(6-4-8)10(11,12)13;1-6(2)8-4-3-7(11)5-9(8)10(12)13;1-7(2)9-5-4-8(12-3)6-10(9)11;1-7(2)10-5-4-9(11)6-8(10)3;2*1-8(2)10-6-4-9(3)5-7-10;1-8(2)10-6-4-5-9(3)7-10;1-8(2)10-7-5-4-6-9(10)3;1-6(2)8-4-3-7(10)5-9(8)11;1-6(2)8-4-3-7(11)5-9(8)10;2*1-6(2)8-4-3-7(10)5-9(8)11;1-7(2)8-3-5-9(10)6-4-8;1-8(2)9-6-4-3-5-7-9/h5,7,9-10H,3-4,6,8H2,1-2H3;3-10H,1-2H3;3-6H,1-2H3;4*3-6H,1-2H3;3-7H,1-2H3;3-6H,1-2H3,(H2,12,13);4-7H,1-3H3;4-7H,1-3H3;4*4-8H,1-3H3;4*3-6H,1-2H3;3-7,10H,1-2H3;3-8H,1-2H3
InChIKeyUJRDBUZKBBHXQK-UHFFFAOYSA-N
XLogP73.70
TPSA72.55 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds23
Heavy Atoms251
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003631.99
LogP ≤ 573.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-chloro-4-fluoro-1-propan-2-ylbenzene;4-chloro-2-fluoro-1-propan-2-ylbenzene;2-chloro-1-propan-2-yl-4-(trifluoromethyl)benzene;4-chloro-1-propan-2-yl-2-(trifluoromethyl)benzene;cumene;2,4-dichloro-1-propan-2-ylbenzene;2,4-difluoro-1-propan-2-ylbenzene;2-fluoro-4-methoxy-1-propan-2-ylbenzene;4-fluoro-2-methyl-1-propan-2-ylbenzene;5-fluoro-2-propan-2-ylbenzamide;2-fluoro-1-propan-2-yl-4-(trifluoromethyl)benzene;4-fluoro-1-propan-2-yl-2-(trifluoromethyl)benzene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;bis(1-methyl-4-propan-2-ylbenzene);1-propan-2-yl-2,4-bis(trifluoromethyl)benzene;1-propan-2-ylnaphthalene;4-propan-2-ylphenol;5-propan-2-yl-1,2,3,4-tetrahydronaphthalene;1-propan-2-yl-4-(trifluoromethyl)benzene with MolForge

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Related Compounds

Tris(4-chloro-2-methyl-1-propan-2-ylbenzene);cumene;tetrakis(4-fluoro-2-methyl-1-propan-2-ylbenzene);5-fluoro-2-propan-2-ylbenzamide;1-fluoro-2-propan-2-ylbenzene;1-fluoro-3-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;methane;4-methoxy-2-methyl-1-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;bis(1-methyl-4-propan-2-ylbenzene);tris(2-methyl-1-propan-2-yl-4-(trifluoromethyl)benzene);1-propan-2-ylnaphthalene;4-propan-2-ylphenol;5-propan-2-yl-1,2,3,4-tetrahydronaphthalene;1-propan-2-yl-4-(trifluoromethyl)benzene;hydrochloride
CID 158244143
2-(5-Chloro-2-methoxyphenyl)-3-(2-fluoro-4-hydroxyphenyl)-5-(trifluoromethyl)benzamide;2-(2-ethenylphenyl)-3-(2-fluoro-4-hydroxyphenyl)-5-(trifluoromethyl)benzamide
CID 159008059
Tris(4-chloro-2-methyl-1-propan-2-ylbenzene);cumene;1-ethoxy-4-propan-2-ylbenzene;tris(4-fluoro-2-methyl-1-propan-2-ylbenzene);5-fluoro-2-propan-2-ylbenzamide;2-fluoro-1-propan-2-yl-4-(trifluoromethyl)benzene;4-fluoro-1-propan-2-yl-2-(trifluoromethyl)benzene;4-methoxy-2-methyl-1-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;tris(1-methyl-4-propan-2-ylbenzene);1-[(2-methylpropan-2-yl)oxy]-4-propan-2-ylbenzene;bis(2-methyl-1-propan-2-yl-4-(trifluoromethyl)benzene);1-propan-2-ylnaphthalene;4-propan-2-ylphenol;1-propan-2-yl-4-propan-2-yloxybenzene;5-propan-2-yl-1,2,3,4-tetrahydronaphthalene;bis(1-propan-2-yl-4-(trifluoromethyl)benzene)
CID 159103262
2-Chloro-1-methyl-4-propan-2-ylbenzene;4-chloro-2-methyl-1-propan-2-ylbenzene;2-chloro-4-propan-2-ylphenol;1,3-dimethyl-5-propan-2-ylbenzene;1-ethoxy-2-fluoro-4-propan-2-ylbenzene;1-fluoro-2-methyl-4-propan-2-ylbenzene;bis(2-fluoro-1-methyl-4-propan-2-ylbenzene);1-fluoro-3-propan-2-yl-5-propan-2-yloxybenzene;2-methyl-4-propan-2-ylbenzamide;1-methyl-3-propan-2-ylbenzene;(3-methyl-5-propan-2-ylphenyl)methanol;2-(4-propan-2-ylphenyl)propan-2-ol;1-propan-2-yl-4-propan-2-yloxybenzene;1-propan-2-yl-4-(trifluoromethoxy)benzene;1,1,1-trifluoro-2-(3-propan-2-ylphenyl)propan-2-ol
CID 159405151
1-Chloro-2,4-dimethylbenzene;4-chloro-1,2-dimethylbenzene;1-chloro-3-fluoro-2-methylbenzene;1-chloro-3-methoxy-2-methylbenzene;1-chloro-4-methoxy-2-methylbenzene;4-chloro-3-methylbenzamide;4-chloro-3-methylbenzoic acid;3-chloro-2-methylphenol;4-chloro-3-methylphenol;1-(4-chloro-3-methylphenyl)ethanone;(4-chloro-3-methylphenyl)methanol;1-chloro-2-methyl-4-(trifluoromethoxy)benzene;1-chloro-2-methyl-4-(trifluoromethyl)benzene;bis((3,4-dimethylphenyl)methanol);4-fluoro-1,2-dimethylbenzene;4-fluoro-3-methoxy-5-methylbenzoic acid;1,2,3,5-tetramethylbenzene;1,2,3-trimethylbenzene;1,2,4-trimethylbenzene
CID 159424168
Bis(1-chloro-4-methyl-2-propan-2-ylbenzene);2-chloro-1-methyl-4-propan-2-ylbenzene;1-chloro-2-propan-2-ylbenzene;cumene;1,3-dichloro-2-propan-2-ylbenzene;1,2-difluoro-4-(2-propan-2-ylphenyl)benzene;1,4-dimethyl-2-propan-2-ylbenzene;1,2-di(propan-2-yl)benzene;1-ethyl-2-propan-2-ylbenzene;1-fluoro-2-propan-2-ylbenzene;bis(1-fluoro-4-(2-propan-2-ylphenyl)benzene);1-methoxy-4-propan-2-ylbenzene;1-methyl-2-propan-2-ylbenzene;bis(1-methyl-3-propan-2-ylbenzene);1-methyl-4-propan-2-ylbenzene;1-phenyl-2-propan-2-ylbenzene;(2-propan-2-ylphenyl)methanol;[3-(2-propan-2-ylphenyl)phenyl]methanamine;[4-(2-propan-2-ylphenyl)phenyl]methanamine;1-propan-2-yl-2-(trifluoromethyl)benzene
CID 159530353
Tris(4-chloro-2-methyl-1-propan-2-ylbenzene);cumene;1-ethoxy-4-propan-2-ylbenzene;tris(4-fluoro-2-methyl-1-propan-2-ylbenzene);5-fluoro-2-propan-2-ylbenzamide;2-fluoro-1-propan-2-yl-4-(trifluoromethyl)benzene;4-fluoro-1-propan-2-yl-2-(trifluoromethyl)benzene;4-methoxy-2-methyl-1-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;tris(1-methyl-4-propan-2-ylbenzene);1-[(2-methylpropan-2-yl)oxy]-4-propan-2-ylbenzene;bis(2-methyl-1-propan-2-yl-4-(trifluoromethyl)benzene);1-propan-2-ylnaphthalene;4-propan-2-ylphenol;1-propan-2-yl-4-propan-2-yloxybenzene;5-propan-2-yl-1,2,3,4-tetrahydronaphthalene;1-propan-2-yl-4-(trifluoromethyl)benzene
CID 159595389
4-(4-Tert-butylphenyl)-2,6-di(propan-2-yl)phenol;4-(3-chloro-2-fluorophenyl)-2,6-di(propan-2-yl)phenol;4-(3-chloro-4-fluorophenyl)-2,6-di(propan-2-yl)phenol;4-(4-chlorophenyl)-2,6-di(propan-2-yl)phenol;4-(2,3-dichlorophenyl)-2,6-di(propan-2-yl)phenol;4-(2,3-difluorophenyl)-2,6-di(propan-2-yl)phenol;2,6-di(propan-2-yl)-4-[4-(trifluoromethoxy)phenyl]phenol;4-(4-fluorophenyl)-2,6-di(propan-2-yl)phenol;4-[4-hydroxy-3,5-di(propan-2-yl)phenyl]benzamide;4-(4-phenylphenyl)-2,6-di(propan-2-yl)phenol
CID 159905039
Tris(4-chloro-2-methyl-1-propan-2-ylbenzene);cumene;tetrakis(4-fluoro-2-methyl-1-propan-2-ylbenzene);5-fluoro-2-propan-2-ylbenzamide;4-methoxy-2-methyl-1-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;hexakis(1-methyl-4-propan-2-ylbenzene);tris(2-methyl-1-propan-2-yl-4-(trifluoromethyl)benzene);1-propan-2-ylnaphthalene;4-propan-2-ylphenol;5-propan-2-yl-1,2,3,4-tetrahydronaphthalene;bis(1-propan-2-yl-4-(trifluoromethyl)benzene)
CID 160691493
2-(3-Chloro-5-methylphenyl)-3-(4-hydroxyphenyl)-5-(trifluoromethyl)benzamide;2-(2,5-dichlorophenyl)-3-(4-hydroxyphenyl)-5-(trifluoromethyl)benzamide
CID 160903909
2-Tert-butyl-5-(2-methylpropyl)phenol;2-chloro-1-fluoro-4-(2-methylpropyl)benzene;2-chloro-5-(2-methylpropyl)phenol;1-(difluoromethoxy)-3-(2-methylpropyl)benzene;1,2-difluoro-4-(2-methylpropyl)benzene;1-fluoro-3-(2-methylpropyl)benzene;1-fluoro-4-(2-methylpropyl)benzene;2-fluoro-5-(2-methylpropyl)phenol;3-(2-methylpropyl)benzamide;4-(2-methylpropyl)phenol;1-(2-methylpropyl)-3-(2,2,2-trifluoroethoxy)benzene;1-(2-methylpropyl)-3-(trifluoromethoxy)benzene;1-(2-methylpropyl)-3-(trifluoromethyl)benzene;1-(2-methylpropyl)-4-(trifluoromethyl)benzene
CID 161021514
4-(4-Tert-butylphenyl)-2,6-di(propan-2-yl)phenol;4-(3-chloro-4-fluorophenyl)-2,6-di(propan-2-yl)phenol;4-(4-chlorophenyl)-2,6-di(propan-2-yl)phenol;4-(2,3-dichlorophenyl)-2,6-di(propan-2-yl)phenol;2,6-di(propan-2-yl)-4-[4-(trifluoromethoxy)phenyl]phenol;4-(4-fluorophenyl)-2,6-di(propan-2-yl)phenol;4-[4-hydroxy-3,5-di(propan-2-yl)phenyl]benzamide;methane;4-(4-phenylphenyl)-2,6-di(propan-2-yl)phenol
CID 161940506

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-fluoro-1-propan-2-ylbenzene;4-chloro-2-fluoro-1-propan-2-ylbenzene;2-chloro-1-propan-2-yl-4-(trifluoromethyl)benzene;4-chloro-1-propan-2-yl-2-(trifluoromethyl)benzene;cumene;2,4-dichloro-1-propan-2-ylbenzene;2,4-difluoro-1-propan-2-ylbenzene;2-fluoro-4-methoxy-1-propan-2-ylbenzene;4-fluoro-2-methyl-1-propan-2-ylbenzene;5-fluoro-2-propan-2-ylbenzamide;2-fluoro-1-propan-2-yl-4-(trifluoromethyl)benzene;4-fluoro-1-propan-2-yl-2-(trifluoromethyl)benzene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;bis(1-methyl-4-propan-2-ylbenzene);1-propan-2-yl-2,4-bis(trifluoromethyl)benzene;1-propan-2-ylnaphthalene;4-propan-2-ylphenol;5-propan-2-yl-1,2,3,4-tetrahydronaphthalene;1-propan-2-yl-4-(trifluoromethyl)benzene?
The IUPAC name of 2-chloro-4-fluoro-1-propan-2-ylbenzene;4-chloro-2-fluoro-1-propan-2-ylbenzene;2-chloro-1-propan-2-yl-4-(trifluoromethyl)benzene;4-chloro-1-propan-2-yl-2-(trifluoromethyl)benzene;cumene;2,4-dichloro-1-propan-2-ylbenzene;2,4-difluoro-1-propan-2-ylbenzene;2-fluoro-4-methoxy-1-propan-2-ylbenzene;4-fluoro-2-methyl-1-propan-2-ylbenzene;5-fluoro-2-propan-2-ylbenzamide;2-fluoro-1-propan-2-yl-4-(trifluoromethyl)benzene;4-fluoro-1-propan-2-yl-2-(trifluoromethyl)benzene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;bis(1-methyl-4-propan-2-ylbenzene);1-propan-2-yl-2,4-bis(trifluoromethyl)benzene;1-propan-2-ylnaphthalene;4-propan-2-ylphenol;5-propan-2-yl-1,2,3,4-tetrahydronaphthalene;1-propan-2-yl-4-(trifluoromethyl)benzene (CID 161110886) is 2-chloro-4-fluoro-1-propan-2-ylbenzene;4-chloro-2-fluoro-1-propan-2-ylbenzene;2-chloro-1-propan-2-yl-4-(trifluoromethyl)benzene;4-chloro-1-propan-2-yl-2-(trifluoromethyl)benzene;cumene;2,4-dichloro-1-propan-2-ylbenzene;2,4-difluoro-1-propan-2-ylbenzene;2-fluoro-4-methoxy-1-propan-2-ylbenzene;4-fluoro-2-methyl-1-propan-2-ylbenzene;5-fluoro-2-propan-2-ylbenzamide;2-fluoro-1-propan-2-yl-4-(trifluoromethyl)benzene;4-fluoro-1-propan-2-yl-2-(trifluoromethyl)benzene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;bis(1-methyl-4-propan-2-ylbenzene);1-propan-2-yl-2,4-bis(trifluoromethyl)benzene;1-propan-2-ylnaphthalene;4-propan-2-ylphenol;5-propan-2-yl-1,2,3,4-tetrahydronaphthalene;1-propan-2-yl-4-(trifluoromethyl)benzene.
What is the SMILES notation for 2-chloro-4-fluoro-1-propan-2-ylbenzene;4-chloro-2-fluoro-1-propan-2-ylbenzene;2-chloro-1-propan-2-yl-4-(trifluoromethyl)benzene;4-chloro-1-propan-2-yl-2-(trifluoromethyl)benzene;cumene;2,4-dichloro-1-propan-2-ylbenzene;2,4-difluoro-1-propan-2-ylbenzene;2-fluoro-4-methoxy-1-propan-2-ylbenzene;4-fluoro-2-methyl-1-propan-2-ylbenzene;5-fluoro-2-propan-2-ylbenzamide;2-fluoro-1-propan-2-yl-4-(trifluoromethyl)benzene;4-fluoro-1-propan-2-yl-2-(trifluoromethyl)benzene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;bis(1-methyl-4-propan-2-ylbenzene);1-propan-2-yl-2,4-bis(trifluoromethyl)benzene;1-propan-2-ylnaphthalene;4-propan-2-ylphenol;5-propan-2-yl-1,2,3,4-tetrahydronaphthalene;1-propan-2-yl-4-(trifluoromethyl)benzene?
The canonical SMILES for 2-chloro-4-fluoro-1-propan-2-ylbenzene;4-chloro-2-fluoro-1-propan-2-ylbenzene;2-chloro-1-propan-2-yl-4-(trifluoromethyl)benzene;4-chloro-1-propan-2-yl-2-(trifluoromethyl)benzene;cumene;2,4-dichloro-1-propan-2-ylbenzene;2,4-difluoro-1-propan-2-ylbenzene;2-fluoro-4-methoxy-1-propan-2-ylbenzene;4-fluoro-2-methyl-1-propan-2-ylbenzene;5-fluoro-2-propan-2-ylbenzamide;2-fluoro-1-propan-2-yl-4-(trifluoromethyl)benzene;4-fluoro-1-propan-2-yl-2-(trifluoromethyl)benzene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;bis(1-methyl-4-propan-2-ylbenzene);1-propan-2-yl-2,4-bis(trifluoromethyl)benzene;1-propan-2-ylnaphthalene;4-propan-2-ylphenol;5-propan-2-yl-1,2,3,4-tetrahydronaphthalene;1-propan-2-yl-4-(trifluoromethyl)benzene is CC(C)c1ccc(C(F)(F)F)cc1.CC(C)c1ccc(C(F)(F)F)cc1C(F)(F)F.CC(C)c1ccc(C(F)(F)F)cc1Cl.CC(C)c1ccc(C(F)(F)F)cc1F.CC(C)c1ccc(Cl)cc1C(F)(F)F.CC(C)c1ccc(Cl)cc1Cl.CC(C)c1ccc(Cl)cc1F.CC(C)c1ccc(F)cc1C(F)(F)F.CC(C)c1ccc(F)cc1C(N)=O.CC(C)c1ccc(F)cc1Cl.CC(C)c1ccc(F)cc1F.CC(C)c1ccc(O)cc1.CC(C)c1cccc2c1CCCC2.CC(C)c1cccc2ccccc12.CC(C)c1ccccc1.COc1ccc(C(C)C)c(F)c1.Cc1cc(F)ccc1C(C)C.Cc1ccc(C(C)C)cc1.Cc1ccc(C(C)C)cc1.Cc1cccc(C(C)C)c1.Cc1ccccc1C(C)C.
What is the InChIKey of 2-chloro-4-fluoro-1-propan-2-ylbenzene;4-chloro-2-fluoro-1-propan-2-ylbenzene;2-chloro-1-propan-2-yl-4-(trifluoromethyl)benzene;4-chloro-1-propan-2-yl-2-(trifluoromethyl)benzene;cumene;2,4-dichloro-1-propan-2-ylbenzene;2,4-difluoro-1-propan-2-ylbenzene;2-fluoro-4-methoxy-1-propan-2-ylbenzene;4-fluoro-2-methyl-1-propan-2-ylbenzene;5-fluoro-2-propan-2-ylbenzamide;2-fluoro-1-propan-2-yl-4-(trifluoromethyl)benzene;4-fluoro-1-propan-2-yl-2-(trifluoromethyl)benzene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;bis(1-methyl-4-propan-2-ylbenzene);1-propan-2-yl-2,4-bis(trifluoromethyl)benzene;1-propan-2-ylnaphthalene;4-propan-2-ylphenol;5-propan-2-yl-1,2,3,4-tetrahydronaphthalene;1-propan-2-yl-4-(trifluoromethyl)benzene?
The InChIKey is UJRDBUZKBBHXQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18.C13H14.C11H10F6.2C10H10ClF3.2C10H10F4.C10H11F3.C10H12FNO.C10H13FO.C10H13F.4C10H14.C9H10Cl2.2C9H10ClF.C9H10F2.C9H12O.C9H12/c2*1-10(2)12-9-5-7-11-6-3-4-8-13(11)12;1-6(2)8-4-3-7(10(12,13)14)5-9(8)11(15,16)17;1-6(2)8-4-3-7(11)5-9(8)10(12,13)14;1-6(2)8-4-3-7(5-9(8)11)10(12,13)14;1-6(2)8-4-3-7(11)5-9(8)10(12,13)14;1-6(2)8-4-3-7(5-9(8)11)10(12,13)14;1-7(2)8-3-5-9(6-4-8)10(11,12)13;1-6(2)8-4-3-7(11)5-9(8)10(12)13;1-7(2)9-5-4-8(12-3)6-10(9)11;1-7(2)10-5-4-9(11)6-8(10)3;2*1-8(2)10-6-4-9(3)5-7-10;1-8(2)10-6-4-5-9(3)7-10;1-8(2)10-7-5-4-6-9(10)3;1-6(2)8-4-3-7(10)5-9(8)11;1-6(2)8-4-3-7(11)5-9(8)10;2*1-6(2)8-4-3-7(10)5-9(8)11;1-7(2)8-3-5-9(10)6-4-8;1-8(2)9-6-4-3-5-7-9/h5,7,9-10H,3-4,6,8H2,1-2H3;3-10H,1-2H3;3-6H,1-2H3;4*3-6H,1-2H3;3-7H,1-2H3;3-6H,1-2H3,(H2,12,13);4-7H,1-3H3;4-7H,1-3H3;4*4-8H,1-3H3;4*3-6H,1-2H3;3-7,10H,1-2H3;3-8H,1-2H3.
What are the key properties of 2-chloro-4-fluoro-1-propan-2-ylbenzene;4-chloro-2-fluoro-1-propan-2-ylbenzene;2-chloro-1-propan-2-yl-4-(trifluoromethyl)benzene;4-chloro-1-propan-2-yl-2-(trifluoromethyl)benzene;cumene;2,4-dichloro-1-propan-2-ylbenzene;2,4-difluoro-1-propan-2-ylbenzene;2-fluoro-4-methoxy-1-propan-2-ylbenzene;4-fluoro-2-methyl-1-propan-2-ylbenzene;5-fluoro-2-propan-2-ylbenzamide;2-fluoro-1-propan-2-yl-4-(trifluoromethyl)benzene;4-fluoro-1-propan-2-yl-2-(trifluoromethyl)benzene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;bis(1-methyl-4-propan-2-ylbenzene);1-propan-2-yl-2,4-bis(trifluoromethyl)benzene;1-propan-2-ylnaphthalene;4-propan-2-ylphenol;5-propan-2-yl-1,2,3,4-tetrahydronaphthalene;1-propan-2-yl-4-(trifluoromethyl)benzene?
2-chloro-4-fluoro-1-propan-2-ylbenzene;4-chloro-2-fluoro-1-propan-2-ylbenzene;2-chloro-1-propan-2-yl-4-(trifluoromethyl)benzene;4-chloro-1-propan-2-yl-2-(trifluoromethyl)benzene;cumene;2,4-dichloro-1-propan-2-ylbenzene;2,4-difluoro-1-propan-2-ylbenzene;2-fluoro-4-methoxy-1-propan-2-ylbenzene;4-fluoro-2-methyl-1-propan-2-ylbenzene;5-fluoro-2-propan-2-ylbenzamide;2-fluoro-1-propan-2-yl-4-(trifluoromethyl)benzene;4-fluoro-1-propan-2-yl-2-(trifluoromethyl)benzene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;bis(1-methyl-4-propan-2-ylbenzene);1-propan-2-yl-2,4-bis(trifluoromethyl)benzene;1-propan-2-ylnaphthalene;4-propan-2-ylphenol;5-propan-2-yl-1,2,3,4-tetrahydronaphthalene;1-propan-2-yl-4-(trifluoromethyl)benzene has a molecular weight of 3631.99 g/mol, XLogP of 73.70, 23 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-fluoro-1-propan-2-ylbenzene;4-chloro-2-fluoro-1-propan-2-ylbenzene;2-chloro-1-propan-2-yl-4-(trifluoromethyl)benzene;4-chloro-1-propan-2-yl-2-(trifluoromethyl)benzene;cumene;2,4-dichloro-1-propan-2-ylbenzene;2,4-difluoro-1-propan-2-ylbenzene;2-fluoro-4-methoxy-1-propan-2-ylbenzene;4-fluoro-2-methyl-1-propan-2-ylbenzene;5-fluoro-2-propan-2-ylbenzamide;2-fluoro-1-propan-2-yl-4-(trifluoromethyl)benzene;4-fluoro-1-propan-2-yl-2-(trifluoromethyl)benzene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;bis(1-methyl-4-propan-2-ylbenzene);1-propan-2-yl-2,4-bis(trifluoromethyl)benzene;1-propan-2-ylnaphthalene;4-propan-2-ylphenol;5-propan-2-yl-1,2,3,4-tetrahydronaphthalene;1-propan-2-yl-4-(trifluoromethyl)benzene is sourced from PubChem (CID 161110886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).