1-chloro-3-fluoro-2-propan-2-ylbenzene;1-chloro-2-propan-2-ylbenzene;2,6-dimethyl-4-propan-2-ylpyridine;1-fluoro-3-methoxy-2-propan-2-ylbenzene;3-fluoro-2-propan-2-ylbenzonitrile;1-(3-fluoro-2-propan-2-ylphenyl)-N,N-dimethylmethanamine;3-fluoro-4-propan-2-ylpyridine;bis(1-fluoro-2-propan-2-yl-3-(trifluoromethyl)benzene);1-methyl-4-propan-2-ylpyrazole;2-methyl-3-propan-2-ylpyridine;4-propan-2-ylmorpholine;1-propan-2-yl-2-(trifluoromethoxy)benzene

C121H158Cl2F16N8O3 — CID 167683069

IUPAC1-chloro-3-fluoro-2-propan-2-ylbenzene;1-chloro-2-propan-2-ylbenzene;2,6-dimethyl-4-propan-2-ylpyridine;1-fluoro-3-methoxy-2-propan-2-ylbenzene;3-fluoro-2-propan-2-ylbenzonitrile;1-(3-fluoro-2-propan-2-ylphenyl)-N,N-dimethylmethanamine;3-fluoro-4-propan-2-ylpyridine;bis(1-fluoro-2-propan-2-yl-3-(trifluoromethyl)benzene);1-methyl-4-propan-2-ylpyrazole;2-methyl-3-propan-2-ylpyridine;4-propan-2-ylmorpholine;1-propan-2-yl-2-(trifluoromethoxy)benzene
SMILESCC(C)N1CCOCC1.CC(C)c1c(F)cccc1C#N.CC(C)c1c(F)cccc1C(F)(F)F.CC(C)c1c(F)cccc1C(F)(F)F.CC(C)c1c(F)cccc1CN(C)C.CC(C)c1c(F)cccc1Cl.CC(C)c1ccccc1Cl.CC(C)c1ccccc1OC(F)(F)F.CC(C)c1ccncc1F.CC(C)c1cnn(C)c1.COc1cccc(F)c1C(C)C.Cc1cc(C(C)C)cc(C)n1.Cc1ncccc1C(C)C
InChIInChI=1S/C12H18FN.2C10H10F4.C10H11F3O.C10H10FN.C10H13FO.C10H15N.C9H10ClF.C9H11Cl.C9H13N.C8H10FN.C7H12N2.C7H15NO/c1-9(2)12-10(8-14(3)4)6-5-7-11(12)13;2*1-6(2)9-7(10(12,13)14)4-3-5-8(9)11;1-7(2)8-5-3-4-6-9(8)14-10(11,12)13;1-7(2)10-8(6-12)4-3-5-9(10)11;1-7(2)10-8(11)5-4-6-9(10)12-3;1-7(2)10-5-8(3)11-9(4)6-10;1-6(2)9-7(10)4-3-5-8(9)11;1-7(2)8-5-3-4-6-9(8)10;1-7(2)9-5-4-6-10-8(9)3;1-6(2)7-3-4-10-5-8(7)9;1-6(2)7-4-8-9(3)5-7;1-7(2)8-3-5-9-6-4-8/h5-7,9H,8H2,1-4H3;2*3-6H,1-2H3;3-7H,1-2H3;3-5,7H,1-2H3;4-7H,1-3H3;5-7H,1-4H3;3-6H,1-2H3;3-7H,1-2H3;4-7H,1-3H3;3-6H,1-2H3;4-6H,1-3H3;7H,3-6H2,1-2H3
InChIKeyVUVXRPDRZITFKW-UHFFFAOYSA-N
MW2147.52 g/mol
LogP37.45
Rot. Bonds17

About 1-chloro-3-fluoro-2-propan-2-ylbenzene;1-chloro-2-propan-2-ylbenzene;2,6-dimethyl-4-propan-2-ylpyridine;1-fluoro-3-methoxy-2-propan-2-ylbenzene;3-fluoro-2-propan-2-ylbenzonitrile;1-(3-fluoro-2-propan-2-ylphenyl)-N,N-dimethylmethanamine;3-fluoro-4-propan-2-ylpyridine;bis(1-fluoro-2-propan-2-yl-3-(trifluoromethyl)benzene);1-methyl-4-propan-2-ylpyrazole;2-methyl-3-propan-2-ylpyridine;4-propan-2-ylmorpholine;1-propan-2-yl-2-(trifluoromethoxy)benzene

1-chloro-3-fluoro-2-propan-2-ylbenzene;1-chloro-2-propan-2-ylbenzene;2,6-dimethyl-4-propan-2-ylpyridine;1-fluoro-3-methoxy-2-propan-2-ylbenzene;3-fluoro-2-propan-2-ylbenzonitrile;1-(3-fluoro-2-propan-2-ylphenyl)-N,N-dimethylmethanamine;3-fluoro-4-propan-2-ylpyridine;bis(1-fluoro-2-propan-2-yl-3-(trifluoromethyl)benzene);1-methyl-4-propan-2-ylpyrazole;2-methyl-3-propan-2-ylpyridine;4-propan-2-ylmorpholine;1-propan-2-yl-2-(trifluoromethoxy)benzene (PubChem CID 167683069) has the molecular formula C121H158Cl2F16N8O3 and a molecular weight of 2147.52 g/mol. Its IUPAC name is 1-chloro-3-fluoro-2-propan-2-ylbenzene;1-chloro-2-propan-2-ylbenzene;2,6-dimethyl-4-propan-2-ylpyridine;1-fluoro-3-methoxy-2-propan-2-ylbenzene;3-fluoro-2-propan-2-ylbenzonitrile;1-(3-fluoro-2-propan-2-ylphenyl)-N,N-dimethylmethanamine;3-fluoro-4-propan-2-ylpyridine;bis(1-fluoro-2-propan-2-yl-3-(trifluoromethyl)benzene);1-methyl-4-propan-2-ylpyrazole;2-methyl-3-propan-2-ylpyridine;4-propan-2-ylmorpholine;1-propan-2-yl-2-(trifluoromethoxy)benzene.

Molecular Properties

Compound Name1-chloro-3-fluoro-2-propan-2-ylbenzene;1-chloro-2-propan-2-ylbenzene;2,6-dimethyl-4-propan-2-ylpyridine;1-fluoro-3-methoxy-2-propan-2-ylbenzene;3-fluoro-2-propan-2-ylbenzonitrile;1-(3-fluoro-2-propan-2-ylphenyl)-N,N-dimethylmethanamine;3-fluoro-4-propan-2-ylpyridine;bis(1-fluoro-2-propan-2-yl-3-(trifluoromethyl)benzene);1-methyl-4-propan-2-ylpyrazole;2-methyl-3-propan-2-ylpyridine;4-propan-2-ylmorpholine;1-propan-2-yl-2-(trifluoromethoxy)benzene
PubChem CID167683069
Molecular FormulaC121H158Cl2F16N8O3
Molecular Weight2147.52 g/mol
Exact Mass2145.16
IUPAC Name1-chloro-3-fluoro-2-propan-2-ylbenzene;1-chloro-2-propan-2-ylbenzene;2,6-dimethyl-4-propan-2-ylpyridine;1-fluoro-3-methoxy-2-propan-2-ylbenzene;3-fluoro-2-propan-2-ylbenzonitrile;1-(3-fluoro-2-propan-2-ylphenyl)-N,N-dimethylmethanamine;3-fluoro-4-propan-2-ylpyridine;bis(1-fluoro-2-propan-2-yl-3-(trifluoromethyl)benzene);1-methyl-4-propan-2-ylpyrazole;2-methyl-3-propan-2-ylpyridine;4-propan-2-ylmorpholine;1-propan-2-yl-2-(trifluoromethoxy)benzene
SMILESCC(C)N1CCOCC1.CC(C)c1c(F)cccc1C#N.CC(C)c1c(F)cccc1C(F)(F)F.CC(C)c1c(F)cccc1C(F)(F)F.CC(C)c1c(F)cccc1CN(C)C.CC(C)c1c(F)cccc1Cl.CC(C)c1ccccc1Cl.CC(C)c1ccccc1OC(F)(F)F.CC(C)c1ccncc1F.CC(C)c1cnn(C)c1.COc1cccc(F)c1C(C)C.Cc1cc(C(C)C)cc(C)n1.Cc1ncccc1C(C)C
InChIInChI=1S/C12H18FN.2C10H10F4.C10H11F3O.C10H10FN.C10H13FO.C10H15N.C9H10ClF.C9H11Cl.C9H13N.C8H10FN.C7H12N2.C7H15NO/c1-9(2)12-10(8-14(3)4)6-5-7-11(12)13;2*1-6(2)9-7(10(12,13)14)4-3-5-8(9)11;1-7(2)8-5-3-4-6-9(8)14-10(11,12)13;1-7(2)10-8(6-12)4-3-5-9(10)11;1-7(2)10-8(11)5-4-6-9(10)12-3;1-7(2)10-5-8(3)11-9(4)6-10;1-6(2)9-7(10)4-3-5-8(9)11;1-7(2)8-5-3-4-6-9(8)10;1-7(2)9-5-4-6-10-8(9)3;1-6(2)7-3-4-10-5-8(7)9;1-6(2)7-4-8-9(3)5-7;1-7(2)8-3-5-9-6-4-8/h5-7,9H,8H2,1-4H3;2*3-6H,1-2H3;3-7H,1-2H3;3-5,7H,1-2H3;4-7H,1-3H3;5-7H,1-4H3;3-6H,1-2H3;3-7H,1-2H3;4-7H,1-3H3;3-6H,1-2H3;4-6H,1-3H3;7H,3-6H2,1-2H3
InChIKeyVUVXRPDRZITFKW-UHFFFAOYSA-N
XLogP37.45
TPSA114.45 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds17
Heavy Atoms150
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002147.52
LogP ≤ 537.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Analyze 1-chloro-3-fluoro-2-propan-2-ylbenzene;1-chloro-2-propan-2-ylbenzene;2,6-dimethyl-4-propan-2-ylpyridine;1-fluoro-3-methoxy-2-propan-2-ylbenzene;3-fluoro-2-propan-2-ylbenzonitrile;1-(3-fluoro-2-propan-2-ylphenyl)-N,N-dimethylmethanamine;3-fluoro-4-propan-2-ylpyridine;bis(1-fluoro-2-propan-2-yl-3-(trifluoromethyl)benzene);1-methyl-4-propan-2-ylpyrazole;2-methyl-3-propan-2-ylpyridine;4-propan-2-ylmorpholine;1-propan-2-yl-2-(trifluoromethoxy)benzene with MolForge

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Launch Full Analysis

Related Compounds

1-Chloro-3-fluoro-2-propan-2-ylbenzene;1-chloro-2-propan-2-ylbenzene;1,5-difluoro-3-methyl-2-propan-2-ylbenzene;1,3-difluoro-2-propan-2-ylbenzene;1,3-dimethyl-2-propan-2-ylbenzene;2,4-dimethyl-1-propan-2-ylbenzene;1-fluoro-3-methoxy-2-propan-2-ylbenzene;1-fluoro-3-methyl-2-propan-2-ylbenzene;2-fluoro-4-methyl-1-propan-2-ylbenzene;4-fluoro-1-methyl-2-propan-2-ylbenzene;1-fluoro-2-propan-2-ylbenzene;1-methyl-2-propan-2-ylbenzene;4-(2-propan-2-ylphenyl)morpholine;1-(2-propan-2-ylphenyl)pyrazole;1-(2-propan-2-ylphenyl)pyrrolidine;1-propan-2-yl-2-(trifluoromethyl)benzene
CID 157283046
2-Chloro-1-fluoro-3-propan-2-ylbenzene;1-chloro-2-propan-2-yl-4-(trifluoromethoxy)benzene;cumene;1,3-dichloro-2-propan-2-ylbenzene;3,5-dichloro-4-propan-2-ylbenzonitrile;3,5-dichloro-4-propan-2-ylpyridine;1,3-dimethyl-2-propan-2-ylbenzene;bis(3,5-dimethyl-1-(3-propan-2-ylphenyl)pyrazole);2-methyl-2-propan-2-yloxypropane;4-(2-propan-2-ylphenyl)morpholine;4-(3-propan-2-ylphenyl)morpholine;4-(4-propan-2-ylphenyl)morpholine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;1-propan-2-yl-2-(trifluoromethyl)benzene;1-propan-2-yl-3-(trifluoromethyl)benzene;1-propan-2-yl-4-(trifluoromethyl)benzene;2,2,3-trimethylbutane
CID 157869525
1-chloro-3-(2,2-dimethyl-1-phenylpropyl)benzene;1-chloro-2-[(1R)-2-methyl-1-phenylpropyl]benzene;1,3-dichloro-5-(2,2-dimethylpentan-3-yl)benzene;1-(3,3-dimethylbutan-2-yl)-4-(trifluoromethoxy)benzene;1-(2,2-dimethyl-1-phenylpropyl)-3-fluorobenzene;4-(2,2-dimethylpropyl)-1,2-difluorobenzene;1-(2,2-dimethylpropyl)-4-fluorobenzene;5-ethyl-1-methyl-3-phenylpyrazole;4-[(1S)-2-methyl-1-phenylpropyl]pyridine;4-[(1R)-2-methyl-1-phenylpropyl]pyridine;2-methylpropylcyclohexane;1-(2-methylpropyl)-2-(trifluoromethyl)benzene
CID 158057582
2-Chloro-1-fluoro-3-propan-2-ylbenzene;1-chloro-2-propan-2-yl-4-(trifluoromethoxy)benzene;cumene;1,3-dichloro-2-propan-2-ylbenzene;3,5-dichloro-4-propan-2-ylbenzonitrile;3,5-dichloro-4-propan-2-ylpyridine;1-(1,1-difluoroethyl)-2-propan-2-ylbenzene;1,3-dimethyl-2-propan-2-ylbenzene;bis(3,5-dimethyl-1-(3-propan-2-ylphenyl)pyrazole);methane;2-methyl-2-propan-2-yloxypropane;4-(3-propan-2-ylphenyl)morpholine;4-(4-propan-2-ylphenyl)oxane;1-(2-propan-2-ylphenyl)piperidine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;1-propan-2-yl-3-(trifluoromethyl)benzene;1-propan-2-yl-4-(trifluoromethyl)benzene;2,2,3-trimethylbutane
CID 158472794
3-Chloro-2-propan-2-ylpyridine;1-(difluoromethoxy)-2-propan-2-ylbenzene;3,5-difluoro-2-propan-2-ylbenzonitrile;5-fluoro-2-propan-2-ylpyridine;1-methoxy-2-propan-2-ylbenzene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;2-propan-2-ylpyridine;1-propan-2-yl-2-(trifluoromethoxy)benzene
CID 158887047
5-Chloro-2-methoxy-3-propan-2-ylpyridine;1-(difluoromethoxy)-4-fluoro-2-propan-2-ylbenzene;1-ethoxy-4-fluoro-2-propan-2-ylbenzene;4-ethoxy-3-propan-2-ylbenzonitrile;4-fluoro-1-methoxy-2-propan-2-ylbenzene;4-methoxy-3-propan-2-ylbenzonitrile;5-methoxy-6-propan-2-ylpyridine-2-carbonitrile;1-methoxy-2-propan-2-yl-4-(trifluoromethyl)benzene;4-methyl-3-propan-2-ylbenzonitrile;2-propan-2-ylpyridine;4-propan-2-ylpyridine
CID 159069691
1-Benzyl-4-(5-fluoro-2-methylphenyl)pyrazole;2-chloro-3-(5-fluoro-2-methylphenyl)pyridine;4-chloro-3-(5-fluoro-2-methylphenyl)pyridine;3-(5-fluoro-2-methylphenyl)-2-methoxypyridine;3-(5-fluoro-2-methylphenyl)-4-methoxypyridine;3-(5-fluoro-2-methylphenyl)-5-methoxypyridine;5-(5-fluoro-2-methylphenyl)-2-methoxypyridine;3-(5-fluoro-2-methylphenyl)-2-methylpyridine;3-(5-fluoro-2-methylphenyl)-2-(trifluoromethyl)pyridine
CID 159706875
1-chloro-3-(2,2-dimethyl-1-phenylpropyl)benzene;1-chloro-2-[(1S)-2-methyl-1-phenylpropyl]benzene;1-chloro-2-[(1R)-2-methyl-1-phenylpropyl]benzene;1,3-dichloro-5-(2,2-dimethylpentan-3-yl)benzene;1-(3,3-dimethylbutan-2-yl)-4-(trifluoromethoxy)benzene;1-(2,2-dimethyl-1-phenylpropyl)-3-fluorobenzene;2-(2,2-dimethylpropyl)benzonitrile;4-(2,2-dimethylpropyl)-1,2-difluorobenzene;1-(2,2-dimethylpropyl)-4-fluorobenzene;1-methyl-5-(2-methylpropyl)-3-phenylpyrazole;4-[(1S)-2-methyl-1-phenylpropyl]pyridine;4-[(1R)-2-methyl-1-phenylpropyl]pyridine;2-methylpropylcyclohexane;4-(2-methylpropyl)pyridazine;1-(2-methylpropyl)-2-(trifluoromethyl)benzene
CID 160128934
1-Benzyl-4-(5-fluoro-2-methylphenyl)pyrazole;4-chloro-3-(5-fluoro-2-methylphenyl)pyridine;3-(5-fluoro-2-methylphenyl)-2-methoxypyridine;3-(5-fluoro-2-methylphenyl)-4-methoxypyridine;3-(5-fluoro-2-methylphenyl)-5-methoxypyridine;5-(5-fluoro-2-methylphenyl)-2-methoxypyridine;3-(5-fluoro-2-methylphenyl)-2-methylpyridine;3-(5-fluoro-2-methylphenyl)-2-(trifluoromethyl)pyridine
CID 160814591
1-Chloro-2-methylbenzene;3-chloro-2-methylpyridine;1-fluoro-2-methylbenzene;3-fluoro-2-methylpyridine;1-methoxy-2-methylbenzene;2-methylaniline;2-methylbenzonitrile;1-methyl-2-propoxybenzene;2-methylpyridine;1-methyl-2-(trifluoromethoxy)benzene;1-methyl-2-(trifluoromethyl)benzene;toluene;1,2-xylene
CID 160815598
2-Chloro-3-fluoro-6-propan-2-ylpyridine;6-chloro-3-fluoro-2-propan-2-ylpyridine;1,2-difluoro-3-methyl-5-propan-2-ylbenzene;2-ethoxy-6-propan-2-ylpyridine;methane;4-propan-2-yl-1-(2,2,2-trifluoroethyl)pyrazole
CID 167537373
2-Tert-butyl-5-methylpyridine;1-(3-chloro-2,5-dimethylphenyl)bicyclo[3.1.0]hexane;3-[(3-chloro-2,5-dimethylphenyl)methyl]oxane;4-[[2,5-dimethyl-3-(trifluoromethoxy)phenyl]methyl]morpholine;1-methyl-5-(3-methylphenyl)pyrazole
CID 167559194

Frequently Asked Questions

What is the IUPAC name of 1-chloro-3-fluoro-2-propan-2-ylbenzene;1-chloro-2-propan-2-ylbenzene;2,6-dimethyl-4-propan-2-ylpyridine;1-fluoro-3-methoxy-2-propan-2-ylbenzene;3-fluoro-2-propan-2-ylbenzonitrile;1-(3-fluoro-2-propan-2-ylphenyl)-N,N-dimethylmethanamine;3-fluoro-4-propan-2-ylpyridine;bis(1-fluoro-2-propan-2-yl-3-(trifluoromethyl)benzene);1-methyl-4-propan-2-ylpyrazole;2-methyl-3-propan-2-ylpyridine;4-propan-2-ylmorpholine;1-propan-2-yl-2-(trifluoromethoxy)benzene?
The IUPAC name of 1-chloro-3-fluoro-2-propan-2-ylbenzene;1-chloro-2-propan-2-ylbenzene;2,6-dimethyl-4-propan-2-ylpyridine;1-fluoro-3-methoxy-2-propan-2-ylbenzene;3-fluoro-2-propan-2-ylbenzonitrile;1-(3-fluoro-2-propan-2-ylphenyl)-N,N-dimethylmethanamine;3-fluoro-4-propan-2-ylpyridine;bis(1-fluoro-2-propan-2-yl-3-(trifluoromethyl)benzene);1-methyl-4-propan-2-ylpyrazole;2-methyl-3-propan-2-ylpyridine;4-propan-2-ylmorpholine;1-propan-2-yl-2-(trifluoromethoxy)benzene (CID 167683069) is 1-chloro-3-fluoro-2-propan-2-ylbenzene;1-chloro-2-propan-2-ylbenzene;2,6-dimethyl-4-propan-2-ylpyridine;1-fluoro-3-methoxy-2-propan-2-ylbenzene;3-fluoro-2-propan-2-ylbenzonitrile;1-(3-fluoro-2-propan-2-ylphenyl)-N,N-dimethylmethanamine;3-fluoro-4-propan-2-ylpyridine;bis(1-fluoro-2-propan-2-yl-3-(trifluoromethyl)benzene);1-methyl-4-propan-2-ylpyrazole;2-methyl-3-propan-2-ylpyridine;4-propan-2-ylmorpholine;1-propan-2-yl-2-(trifluoromethoxy)benzene.
What is the SMILES notation for 1-chloro-3-fluoro-2-propan-2-ylbenzene;1-chloro-2-propan-2-ylbenzene;2,6-dimethyl-4-propan-2-ylpyridine;1-fluoro-3-methoxy-2-propan-2-ylbenzene;3-fluoro-2-propan-2-ylbenzonitrile;1-(3-fluoro-2-propan-2-ylphenyl)-N,N-dimethylmethanamine;3-fluoro-4-propan-2-ylpyridine;bis(1-fluoro-2-propan-2-yl-3-(trifluoromethyl)benzene);1-methyl-4-propan-2-ylpyrazole;2-methyl-3-propan-2-ylpyridine;4-propan-2-ylmorpholine;1-propan-2-yl-2-(trifluoromethoxy)benzene?
The canonical SMILES for 1-chloro-3-fluoro-2-propan-2-ylbenzene;1-chloro-2-propan-2-ylbenzene;2,6-dimethyl-4-propan-2-ylpyridine;1-fluoro-3-methoxy-2-propan-2-ylbenzene;3-fluoro-2-propan-2-ylbenzonitrile;1-(3-fluoro-2-propan-2-ylphenyl)-N,N-dimethylmethanamine;3-fluoro-4-propan-2-ylpyridine;bis(1-fluoro-2-propan-2-yl-3-(trifluoromethyl)benzene);1-methyl-4-propan-2-ylpyrazole;2-methyl-3-propan-2-ylpyridine;4-propan-2-ylmorpholine;1-propan-2-yl-2-(trifluoromethoxy)benzene is CC(C)N1CCOCC1.CC(C)c1c(F)cccc1C#N.CC(C)c1c(F)cccc1C(F)(F)F.CC(C)c1c(F)cccc1C(F)(F)F.CC(C)c1c(F)cccc1CN(C)C.CC(C)c1c(F)cccc1Cl.CC(C)c1ccccc1Cl.CC(C)c1ccccc1OC(F)(F)F.CC(C)c1ccncc1F.CC(C)c1cnn(C)c1.COc1cccc(F)c1C(C)C.Cc1cc(C(C)C)cc(C)n1.Cc1ncccc1C(C)C.
What is the InChIKey of 1-chloro-3-fluoro-2-propan-2-ylbenzene;1-chloro-2-propan-2-ylbenzene;2,6-dimethyl-4-propan-2-ylpyridine;1-fluoro-3-methoxy-2-propan-2-ylbenzene;3-fluoro-2-propan-2-ylbenzonitrile;1-(3-fluoro-2-propan-2-ylphenyl)-N,N-dimethylmethanamine;3-fluoro-4-propan-2-ylpyridine;bis(1-fluoro-2-propan-2-yl-3-(trifluoromethyl)benzene);1-methyl-4-propan-2-ylpyrazole;2-methyl-3-propan-2-ylpyridine;4-propan-2-ylmorpholine;1-propan-2-yl-2-(trifluoromethoxy)benzene?
The InChIKey is VUVXRPDRZITFKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18FN.2C10H10F4.C10H11F3O.C10H10FN.C10H13FO.C10H15N.C9H10ClF.C9H11Cl.C9H13N.C8H10FN.C7H12N2.C7H15NO/c1-9(2)12-10(8-14(3)4)6-5-7-11(12)13;2*1-6(2)9-7(10(12,13)14)4-3-5-8(9)11;1-7(2)8-5-3-4-6-9(8)14-10(11,12)13;1-7(2)10-8(6-12)4-3-5-9(10)11;1-7(2)10-8(11)5-4-6-9(10)12-3;1-7(2)10-5-8(3)11-9(4)6-10;1-6(2)9-7(10)4-3-5-8(9)11;1-7(2)8-5-3-4-6-9(8)10;1-7(2)9-5-4-6-10-8(9)3;1-6(2)7-3-4-10-5-8(7)9;1-6(2)7-4-8-9(3)5-7;1-7(2)8-3-5-9-6-4-8/h5-7,9H,8H2,1-4H3;2*3-6H,1-2H3;3-7H,1-2H3;3-5,7H,1-2H3;4-7H,1-3H3;5-7H,1-4H3;3-6H,1-2H3;3-7H,1-2H3;4-7H,1-3H3;3-6H,1-2H3;4-6H,1-3H3;7H,3-6H2,1-2H3.
What are the key properties of 1-chloro-3-fluoro-2-propan-2-ylbenzene;1-chloro-2-propan-2-ylbenzene;2,6-dimethyl-4-propan-2-ylpyridine;1-fluoro-3-methoxy-2-propan-2-ylbenzene;3-fluoro-2-propan-2-ylbenzonitrile;1-(3-fluoro-2-propan-2-ylphenyl)-N,N-dimethylmethanamine;3-fluoro-4-propan-2-ylpyridine;bis(1-fluoro-2-propan-2-yl-3-(trifluoromethyl)benzene);1-methyl-4-propan-2-ylpyrazole;2-methyl-3-propan-2-ylpyridine;4-propan-2-ylmorpholine;1-propan-2-yl-2-(trifluoromethoxy)benzene?
1-chloro-3-fluoro-2-propan-2-ylbenzene;1-chloro-2-propan-2-ylbenzene;2,6-dimethyl-4-propan-2-ylpyridine;1-fluoro-3-methoxy-2-propan-2-ylbenzene;3-fluoro-2-propan-2-ylbenzonitrile;1-(3-fluoro-2-propan-2-ylphenyl)-N,N-dimethylmethanamine;3-fluoro-4-propan-2-ylpyridine;bis(1-fluoro-2-propan-2-yl-3-(trifluoromethyl)benzene);1-methyl-4-propan-2-ylpyrazole;2-methyl-3-propan-2-ylpyridine;4-propan-2-ylmorpholine;1-propan-2-yl-2-(trifluoromethoxy)benzene has a molecular weight of 2147.52 g/mol, XLogP of 37.45, 17 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-3-fluoro-2-propan-2-ylbenzene;1-chloro-2-propan-2-ylbenzene;2,6-dimethyl-4-propan-2-ylpyridine;1-fluoro-3-methoxy-2-propan-2-ylbenzene;3-fluoro-2-propan-2-ylbenzonitrile;1-(3-fluoro-2-propan-2-ylphenyl)-N,N-dimethylmethanamine;3-fluoro-4-propan-2-ylpyridine;bis(1-fluoro-2-propan-2-yl-3-(trifluoromethyl)benzene);1-methyl-4-propan-2-ylpyrazole;2-methyl-3-propan-2-ylpyridine;4-propan-2-ylmorpholine;1-propan-2-yl-2-(trifluoromethoxy)benzene is sourced from PubChem (CID 167683069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).