1-bromo-4-propan-2-ylbenzene;4-tert-butyl-2-chloro-1-fluorobenzene;4-tert-butyl-1-fluoro-2-methoxybenzene;1-chloro-4-propan-2-ylbenzene;2-cyclopentyl-1-fluoro-4-propan-2-ylbenzene;1,4-di(propan-2-yl)benzene;2-fluoro-5-propan-2-ylaniline;5-(2-fluoro-5-propan-2-ylphenyl)-3-methyl-1,2,4-oxadiazole;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-methoxy-4-propan-2-yl-2-(trifluoromethyl)benzene;methyl (E)-3-(2-fluoro-5-propan-2-ylphenyl)prop-2-enoate;1-methyl-4-propan-2-yl-2-(trifluoromethyl)benzene;(4-propan-2-ylphenyl)methanol

C152H196BrCl2F12N3O8 — CID 157094023

IUPAC1-bromo-4-propan-2-ylbenzene;4-tert-butyl-2-chloro-1-fluorobenzene;4-tert-butyl-1-fluoro-2-methoxybenzene;1-chloro-4-propan-2-ylbenzene;2-cyclopentyl-1-fluoro-4-propan-2-ylbenzene;1,4-di(propan-2-yl)benzene;2-fluoro-5-propan-2-ylaniline;5-(2-fluoro-5-propan-2-ylphenyl)-3-methyl-1,2,4-oxadiazole;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-methoxy-4-propan-2-yl-2-(trifluoromethyl)benzene;methyl (E)-3-(2-fluoro-5-propan-2-ylphenyl)prop-2-enoate;1-methyl-4-propan-2-yl-2-(trifluoromethyl)benzene;(4-propan-2-ylphenyl)methanol
SMILESCC(C)(C)c1ccc(F)c(Cl)c1.CC(C)c1ccc(Br)cc1.CC(C)c1ccc(C(C)C)cc1.CC(C)c1ccc(CO)cc1.CC(C)c1ccc(Cl)cc1.CC(C)c1ccc(F)c(C2CCCC2)c1.CC(C)c1ccc(F)c(N)c1.COC(=O)/C=C/c1cc(C(C)C)ccc1F.COCc1ccc(C(C)C)cc1.COc1cc(C(C)(C)C)ccc1F.COc1ccc(C(C)C)cc1.COc1ccc(C(C)C)cc1C(F)(F)F.Cc1ccc(C(C)C)cc1C(F)(F)F.Cc1noc(-c2cc(C(C)C)ccc2F)n1
InChIInChI=1S/C14H19F.C13H15FO2.C12H13FN2O.C12H18.C11H13F3O.C11H13F3.C11H15FO.C11H16O.C10H12ClF.2C10H14O.C9H11Br.C9H11Cl.C9H12FN/c1-10(2)12-7-8-14(15)13(9-12)11-5-3-4-6-11;1-9(2)10-4-6-12(14)11(8-10)5-7-13(15)16-3;1-7(2)9-4-5-11(13)10(6-9)12-14-8(3)15-16-12;1-9(2)11-5-7-12(8-6-11)10(3)4;1-7(2)8-4-5-10(15-3)9(6-8)11(12,13)14;1-7(2)9-5-4-8(3)10(6-9)11(12,13)14;1-11(2,3)8-5-6-9(12)10(7-8)13-4;1-9(2)11-6-4-10(5-7-11)8-12-3;1-10(2,3)7-4-5-9(12)8(11)6-7;1-8(2)9-4-6-10(11-3)7-5-9;1-8(2)10-5-3-9(7-11)4-6-10;2*1-7(2)8-3-5-9(10)6-4-8;1-6(2)7-3-4-8(10)9(11)5-7/h7-11H,3-6H2,1-2H3;4-9H,1-3H3;4-7H,1-3H3;5-10H,1-4H3;4-7H,1-3H3;4-7H,1-3H3;5-7H,1-4H3;4-7,9H,8H2,1-3H3;4-6H,1-3H3;4-8H,1-3H3;3-6,8,11H,7H2,1-2H3;2*3-7H,1-2H3;3-6H,11H2,1-2H3/b;7-5+;;;;;;;;;;;;
InChIKeyAEZMSJSFSQKISP-DKDDRIHESA-N
MW2572.04 g/mol
LogP47.51
Rot. Bonds23

About 1-bromo-4-propan-2-ylbenzene;4-tert-butyl-2-chloro-1-fluorobenzene;4-tert-butyl-1-fluoro-2-methoxybenzene;1-chloro-4-propan-2-ylbenzene;2-cyclopentyl-1-fluoro-4-propan-2-ylbenzene;1,4-di(propan-2-yl)benzene;2-fluoro-5-propan-2-ylaniline;5-(2-fluoro-5-propan-2-ylphenyl)-3-methyl-1,2,4-oxadiazole;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-methoxy-4-propan-2-yl-2-(trifluoromethyl)benzene;methyl (E)-3-(2-fluoro-5-propan-2-ylphenyl)prop-2-enoate;1-methyl-4-propan-2-yl-2-(trifluoromethyl)benzene;(4-propan-2-ylphenyl)methanol

1-bromo-4-propan-2-ylbenzene;4-tert-butyl-2-chloro-1-fluorobenzene;4-tert-butyl-1-fluoro-2-methoxybenzene;1-chloro-4-propan-2-ylbenzene;2-cyclopentyl-1-fluoro-4-propan-2-ylbenzene;1,4-di(propan-2-yl)benzene;2-fluoro-5-propan-2-ylaniline;5-(2-fluoro-5-propan-2-ylphenyl)-3-methyl-1,2,4-oxadiazole;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-methoxy-4-propan-2-yl-2-(trifluoromethyl)benzene;methyl (E)-3-(2-fluoro-5-propan-2-ylphenyl)prop-2-enoate;1-methyl-4-propan-2-yl-2-(trifluoromethyl)benzene;(4-propan-2-ylphenyl)methanol (PubChem CID 157094023) has the molecular formula C152H196BrCl2F12N3O8 and a molecular weight of 2572.04 g/mol. Its IUPAC name is 1-bromo-4-propan-2-ylbenzene;4-tert-butyl-2-chloro-1-fluorobenzene;4-tert-butyl-1-fluoro-2-methoxybenzene;1-chloro-4-propan-2-ylbenzene;2-cyclopentyl-1-fluoro-4-propan-2-ylbenzene;1,4-di(propan-2-yl)benzene;2-fluoro-5-propan-2-ylaniline;5-(2-fluoro-5-propan-2-ylphenyl)-3-methyl-1,2,4-oxadiazole;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-methoxy-4-propan-2-yl-2-(trifluoromethyl)benzene;methyl (E)-3-(2-fluoro-5-propan-2-ylphenyl)prop-2-enoate;1-methyl-4-propan-2-yl-2-(trifluoromethyl)benzene;(4-propan-2-ylphenyl)methanol.

Molecular Properties

Compound Name1-bromo-4-propan-2-ylbenzene;4-tert-butyl-2-chloro-1-fluorobenzene;4-tert-butyl-1-fluoro-2-methoxybenzene;1-chloro-4-propan-2-ylbenzene;2-cyclopentyl-1-fluoro-4-propan-2-ylbenzene;1,4-di(propan-2-yl)benzene;2-fluoro-5-propan-2-ylaniline;5-(2-fluoro-5-propan-2-ylphenyl)-3-methyl-1,2,4-oxadiazole;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-methoxy-4-propan-2-yl-2-(trifluoromethyl)benzene;methyl (E)-3-(2-fluoro-5-propan-2-ylphenyl)prop-2-enoate;1-methyl-4-propan-2-yl-2-(trifluoromethyl)benzene;(4-propan-2-ylphenyl)methanol
PubChem CID157094023
Molecular FormulaC152H196BrCl2F12N3O8
Molecular Weight2572.04 g/mol
Exact Mass2568.34
IUPAC Name1-bromo-4-propan-2-ylbenzene;4-tert-butyl-2-chloro-1-fluorobenzene;4-tert-butyl-1-fluoro-2-methoxybenzene;1-chloro-4-propan-2-ylbenzene;2-cyclopentyl-1-fluoro-4-propan-2-ylbenzene;1,4-di(propan-2-yl)benzene;2-fluoro-5-propan-2-ylaniline;5-(2-fluoro-5-propan-2-ylphenyl)-3-methyl-1,2,4-oxadiazole;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-methoxy-4-propan-2-yl-2-(trifluoromethyl)benzene;methyl (E)-3-(2-fluoro-5-propan-2-ylphenyl)prop-2-enoate;1-methyl-4-propan-2-yl-2-(trifluoromethyl)benzene;(4-propan-2-ylphenyl)methanol
SMILESCC(C)(C)c1ccc(F)c(Cl)c1.CC(C)c1ccc(Br)cc1.CC(C)c1ccc(C(C)C)cc1.CC(C)c1ccc(CO)cc1.CC(C)c1ccc(Cl)cc1.CC(C)c1ccc(F)c(C2CCCC2)c1.CC(C)c1ccc(F)c(N)c1.COC(=O)/C=C/c1cc(C(C)C)ccc1F.COCc1ccc(C(C)C)cc1.COc1cc(C(C)(C)C)ccc1F.COc1ccc(C(C)C)cc1.COc1ccc(C(C)C)cc1C(F)(F)F.Cc1ccc(C(C)C)cc1C(F)(F)F.Cc1noc(-c2cc(C(C)C)ccc2F)n1
InChIInChI=1S/C14H19F.C13H15FO2.C12H13FN2O.C12H18.C11H13F3O.C11H13F3.C11H15FO.C11H16O.C10H12ClF.2C10H14O.C9H11Br.C9H11Cl.C9H12FN/c1-10(2)12-7-8-14(15)13(9-12)11-5-3-4-6-11;1-9(2)10-4-6-12(14)11(8-10)5-7-13(15)16-3;1-7(2)9-4-5-11(13)10(6-9)12-14-8(3)15-16-12;1-9(2)11-5-7-12(8-6-11)10(3)4;1-7(2)8-4-5-10(15-3)9(6-8)11(12,13)14;1-7(2)9-5-4-8(3)10(6-9)11(12,13)14;1-11(2,3)8-5-6-9(12)10(7-8)13-4;1-9(2)11-6-4-10(5-7-11)8-12-3;1-10(2,3)7-4-5-9(12)8(11)6-7;1-8(2)9-4-6-10(11-3)7-5-9;1-8(2)10-5-3-9(7-11)4-6-10;2*1-7(2)8-3-5-9(10)6-4-8;1-6(2)7-3-4-8(10)9(11)5-7/h7-11H,3-6H2,1-2H3;4-9H,1-3H3;4-7H,1-3H3;5-10H,1-4H3;4-7H,1-3H3;4-7H,1-3H3;5-7H,1-4H3;4-7,9H,8H2,1-3H3;4-6H,1-3H3;4-8H,1-3H3;3-6,8,11H,7H2,1-2H3;2*3-7H,1-2H3;3-6H,11H2,1-2H3/b;7-5+;;;;;;;;;;;;
InChIKeyAEZMSJSFSQKISP-DKDDRIHESA-N
XLogP47.51
TPSA148.39 Ų
H-Bond Donors2
H-Bond Acceptors11
Rotatable Bonds23
Heavy Atoms178
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002572.04
LogP ≤ 547.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1011

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze 1-bromo-4-propan-2-ylbenzene;4-tert-butyl-2-chloro-1-fluorobenzene;4-tert-butyl-1-fluoro-2-methoxybenzene;1-chloro-4-propan-2-ylbenzene;2-cyclopentyl-1-fluoro-4-propan-2-ylbenzene;1,4-di(propan-2-yl)benzene;2-fluoro-5-propan-2-ylaniline;5-(2-fluoro-5-propan-2-ylphenyl)-3-methyl-1,2,4-oxadiazole;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-methoxy-4-propan-2-yl-2-(trifluoromethyl)benzene;methyl (E)-3-(2-fluoro-5-propan-2-ylphenyl)prop-2-enoate;1-methyl-4-propan-2-yl-2-(trifluoromethyl)benzene;(4-propan-2-ylphenyl)methanol with MolForge

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Related Compounds

1-bromo-4-propan-2-ylbenzene;4-tert-butyl-2-chloro-1-fluorobenzene;4-tert-butyl-2-cyclopentyl-1-fluorobenzene;5-(5-tert-butyl-2-fluorophenyl)-3-methyl-1,2,4-oxadiazole;4-tert-butyl-1-methyl-2-(trifluoromethyl)benzene;1-chloro-4-propan-2-ylbenzene;cumene;1,4-di(propan-2-yl)benzene;2-fluoro-5-propan-2-ylaniline;1-(methoxymethyl)-4-propan-2-ylbenzene;bis(1-methoxy-4-propan-2-ylbenzene);methyl (E)-3-(2-fluoro-5-propan-2-ylphenyl)prop-2-enoate;bis(1-methyl-4-propan-2-ylbenzene);1-methylsulfanyl-4-propan-2-ylbenzene;1-propan-2-ylnaphthalene;(4-propan-2-ylphenyl)methanol
CID 159690009
4-tert-butyl-2-chloro-1-fluorobenzene;1-tert-butyl-4-fluorobenzene;4-tert-butyl-1-fluoro-2-methoxybenzene;2-cyclohexyl-1-fluoro-4-propan-2-ylbenzene;2-cyclopentyl-1-fluoro-4-propan-2-ylbenzene;1,2-difluoro-4-propan-2-ylbenzene;1,4-di(propan-2-yl)benzene;2-fluoro-5-propan-2-ylaniline;1-fluoro-3-propan-2-ylbenzene;5-(2-fluoro-5-propan-2-ylphenyl)-3-methyl-1,2,4-oxadiazole;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methoxy-4-propan-2-yl-2-(trifluoromethyl)benzene;methyl (E)-3-(2-fluoro-5-propan-2-ylphenyl)prop-2-enoate;1-methyl-4-propan-2-yl-2-(trifluoromethyl)benzene;(4-propan-2-ylphenyl)methanol;1-propan-2-yl-3-(1,1,2,2-tetrafluoroethoxy)benzene;1-propan-2-yl-3-(trifluoromethoxy)benzene;1-propan-2-yl-3-(trifluoromethyl)benzene;2,2,3,3-tetrafluoro-6-propan-2-yl-1,4-benzodioxine
CID 157332944
(3,4-dimethoxyphenyl)methyl (E)-3-(5-bromo-2-fluorophenyl)prop-2-enoate
CID 9097003
methyl (E)-3-[2-[4-[[2-(4-chlorophenyl)-5-methoxyphenyl]methoxy]phenyl]-1-cyclohexylimidazol-4-yl]prop-2-enoate
CID 11341937
N-[(1R)-2-[4-(3-chloro-4-fluorophenoxy)phenyl]-1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-2-methoxy-5-[4-(trifluoromethyl)phenyl]benzamide
CID 91209144
sodium;1-(bromomethyl)-4-methoxybenzene;4-chloro-3-(trifluoromethyl)benzaldehyde;cyclohexane;1-cyclohexyl-4-[(4-methoxyphenyl)methoxymethyl]-2-(trifluoromethyl)benzene;[4-cyclohexyl-3-(trifluoromethyl)phenyl]methanol;hydride;4-[(4-methoxyphenyl)methoxymethyl]-1-methyl-2-(trifluoromethyl)benzene;[4-methyl-3-(trifluoromethyl)phenyl]methanol;palladium;bis(tritert-butylphosphane);zinc;hydrobromide
CID 158432094
1-methoxy-4-propan-2-yl-2-(trifluoromethyl)benzene
CID 22952870
(E)-3-(2,5-dimethoxyphenyl)-N-methyl-N-[(4-propan-2-ylphenyl)methyl]prop-2-enamide
CID 2533542
methyl (E)-3-[4-[(4-bromophenyl)methoxy]-3-chloro-5-methoxyphenyl]prop-2-enoate
CID 91685278
2-[[(1R)-1-(4-bromophenyl)ethyl]amino]-N-(4-chloro-2-methoxy-5-methylphenyl)acetamide
CID 40987640
(E)-3-(5-bromo-2-fluorophenyl)-N-[(4-methoxyphenyl)methyl]prop-2-enamide
CID 7959627
methyl (2S)-3-(4-hydroxy-3-iodophenyl)-2-methylpropanoate;methyl (2S)-3-(3-iodo-4-methoxyphenyl)-2-methylpropanoate;methyl (2S)-3-[4-methoxy-3-[(E)-3-methoxy-3-oxoprop-1-enyl]phenyl]-2-methylpropanoate
CID 90684900

Frequently Asked Questions

What is the IUPAC name of 1-bromo-4-propan-2-ylbenzene;4-tert-butyl-2-chloro-1-fluorobenzene;4-tert-butyl-1-fluoro-2-methoxybenzene;1-chloro-4-propan-2-ylbenzene;2-cyclopentyl-1-fluoro-4-propan-2-ylbenzene;1,4-di(propan-2-yl)benzene;2-fluoro-5-propan-2-ylaniline;5-(2-fluoro-5-propan-2-ylphenyl)-3-methyl-1,2,4-oxadiazole;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-methoxy-4-propan-2-yl-2-(trifluoromethyl)benzene;methyl (E)-3-(2-fluoro-5-propan-2-ylphenyl)prop-2-enoate;1-methyl-4-propan-2-yl-2-(trifluoromethyl)benzene;(4-propan-2-ylphenyl)methanol?
The IUPAC name of 1-bromo-4-propan-2-ylbenzene;4-tert-butyl-2-chloro-1-fluorobenzene;4-tert-butyl-1-fluoro-2-methoxybenzene;1-chloro-4-propan-2-ylbenzene;2-cyclopentyl-1-fluoro-4-propan-2-ylbenzene;1,4-di(propan-2-yl)benzene;2-fluoro-5-propan-2-ylaniline;5-(2-fluoro-5-propan-2-ylphenyl)-3-methyl-1,2,4-oxadiazole;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-methoxy-4-propan-2-yl-2-(trifluoromethyl)benzene;methyl (E)-3-(2-fluoro-5-propan-2-ylphenyl)prop-2-enoate;1-methyl-4-propan-2-yl-2-(trifluoromethyl)benzene;(4-propan-2-ylphenyl)methanol (CID 157094023) is 1-bromo-4-propan-2-ylbenzene;4-tert-butyl-2-chloro-1-fluorobenzene;4-tert-butyl-1-fluoro-2-methoxybenzene;1-chloro-4-propan-2-ylbenzene;2-cyclopentyl-1-fluoro-4-propan-2-ylbenzene;1,4-di(propan-2-yl)benzene;2-fluoro-5-propan-2-ylaniline;5-(2-fluoro-5-propan-2-ylphenyl)-3-methyl-1,2,4-oxadiazole;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-methoxy-4-propan-2-yl-2-(trifluoromethyl)benzene;methyl (E)-3-(2-fluoro-5-propan-2-ylphenyl)prop-2-enoate;1-methyl-4-propan-2-yl-2-(trifluoromethyl)benzene;(4-propan-2-ylphenyl)methanol.
What is the SMILES notation for 1-bromo-4-propan-2-ylbenzene;4-tert-butyl-2-chloro-1-fluorobenzene;4-tert-butyl-1-fluoro-2-methoxybenzene;1-chloro-4-propan-2-ylbenzene;2-cyclopentyl-1-fluoro-4-propan-2-ylbenzene;1,4-di(propan-2-yl)benzene;2-fluoro-5-propan-2-ylaniline;5-(2-fluoro-5-propan-2-ylphenyl)-3-methyl-1,2,4-oxadiazole;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-methoxy-4-propan-2-yl-2-(trifluoromethyl)benzene;methyl (E)-3-(2-fluoro-5-propan-2-ylphenyl)prop-2-enoate;1-methyl-4-propan-2-yl-2-(trifluoromethyl)benzene;(4-propan-2-ylphenyl)methanol?
The canonical SMILES for 1-bromo-4-propan-2-ylbenzene;4-tert-butyl-2-chloro-1-fluorobenzene;4-tert-butyl-1-fluoro-2-methoxybenzene;1-chloro-4-propan-2-ylbenzene;2-cyclopentyl-1-fluoro-4-propan-2-ylbenzene;1,4-di(propan-2-yl)benzene;2-fluoro-5-propan-2-ylaniline;5-(2-fluoro-5-propan-2-ylphenyl)-3-methyl-1,2,4-oxadiazole;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-methoxy-4-propan-2-yl-2-(trifluoromethyl)benzene;methyl (E)-3-(2-fluoro-5-propan-2-ylphenyl)prop-2-enoate;1-methyl-4-propan-2-yl-2-(trifluoromethyl)benzene;(4-propan-2-ylphenyl)methanol is CC(C)(C)c1ccc(F)c(Cl)c1.CC(C)c1ccc(Br)cc1.CC(C)c1ccc(C(C)C)cc1.CC(C)c1ccc(CO)cc1.CC(C)c1ccc(Cl)cc1.CC(C)c1ccc(F)c(C2CCCC2)c1.CC(C)c1ccc(F)c(N)c1.COC(=O)/C=C/c1cc(C(C)C)ccc1F.COCc1ccc(C(C)C)cc1.COc1cc(C(C)(C)C)ccc1F.COc1ccc(C(C)C)cc1.COc1ccc(C(C)C)cc1C(F)(F)F.Cc1ccc(C(C)C)cc1C(F)(F)F.Cc1noc(-c2cc(C(C)C)ccc2F)n1.
What is the InChIKey of 1-bromo-4-propan-2-ylbenzene;4-tert-butyl-2-chloro-1-fluorobenzene;4-tert-butyl-1-fluoro-2-methoxybenzene;1-chloro-4-propan-2-ylbenzene;2-cyclopentyl-1-fluoro-4-propan-2-ylbenzene;1,4-di(propan-2-yl)benzene;2-fluoro-5-propan-2-ylaniline;5-(2-fluoro-5-propan-2-ylphenyl)-3-methyl-1,2,4-oxadiazole;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-methoxy-4-propan-2-yl-2-(trifluoromethyl)benzene;methyl (E)-3-(2-fluoro-5-propan-2-ylphenyl)prop-2-enoate;1-methyl-4-propan-2-yl-2-(trifluoromethyl)benzene;(4-propan-2-ylphenyl)methanol?
The InChIKey is AEZMSJSFSQKISP-DKDDRIHESA-N. The full InChI is InChI=1S/C14H19F.C13H15FO2.C12H13FN2O.C12H18.C11H13F3O.C11H13F3.C11H15FO.C11H16O.C10H12ClF.2C10H14O.C9H11Br.C9H11Cl.C9H12FN/c1-10(2)12-7-8-14(15)13(9-12)11-5-3-4-6-11;1-9(2)10-4-6-12(14)11(8-10)5-7-13(15)16-3;1-7(2)9-4-5-11(13)10(6-9)12-14-8(3)15-16-12;1-9(2)11-5-7-12(8-6-11)10(3)4;1-7(2)8-4-5-10(15-3)9(6-8)11(12,13)14;1-7(2)9-5-4-8(3)10(6-9)11(12,13)14;1-11(2,3)8-5-6-9(12)10(7-8)13-4;1-9(2)11-6-4-10(5-7-11)8-12-3;1-10(2,3)7-4-5-9(12)8(11)6-7;1-8(2)9-4-6-10(11-3)7-5-9;1-8(2)10-5-3-9(7-11)4-6-10;2*1-7(2)8-3-5-9(10)6-4-8;1-6(2)7-3-4-8(10)9(11)5-7/h7-11H,3-6H2,1-2H3;4-9H,1-3H3;4-7H,1-3H3;5-10H,1-4H3;4-7H,1-3H3;4-7H,1-3H3;5-7H,1-4H3;4-7,9H,8H2,1-3H3;4-6H,1-3H3;4-8H,1-3H3;3-6,8,11H,7H2,1-2H3;2*3-7H,1-2H3;3-6H,11H2,1-2H3/b;7-5+;;;;;;;;;;;;.
What are the key properties of 1-bromo-4-propan-2-ylbenzene;4-tert-butyl-2-chloro-1-fluorobenzene;4-tert-butyl-1-fluoro-2-methoxybenzene;1-chloro-4-propan-2-ylbenzene;2-cyclopentyl-1-fluoro-4-propan-2-ylbenzene;1,4-di(propan-2-yl)benzene;2-fluoro-5-propan-2-ylaniline;5-(2-fluoro-5-propan-2-ylphenyl)-3-methyl-1,2,4-oxadiazole;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-methoxy-4-propan-2-yl-2-(trifluoromethyl)benzene;methyl (E)-3-(2-fluoro-5-propan-2-ylphenyl)prop-2-enoate;1-methyl-4-propan-2-yl-2-(trifluoromethyl)benzene;(4-propan-2-ylphenyl)methanol?
1-bromo-4-propan-2-ylbenzene;4-tert-butyl-2-chloro-1-fluorobenzene;4-tert-butyl-1-fluoro-2-methoxybenzene;1-chloro-4-propan-2-ylbenzene;2-cyclopentyl-1-fluoro-4-propan-2-ylbenzene;1,4-di(propan-2-yl)benzene;2-fluoro-5-propan-2-ylaniline;5-(2-fluoro-5-propan-2-ylphenyl)-3-methyl-1,2,4-oxadiazole;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-methoxy-4-propan-2-yl-2-(trifluoromethyl)benzene;methyl (E)-3-(2-fluoro-5-propan-2-ylphenyl)prop-2-enoate;1-methyl-4-propan-2-yl-2-(trifluoromethyl)benzene;(4-propan-2-ylphenyl)methanol has a molecular weight of 2572.04 g/mol, XLogP of 47.51, 23 rotatable bonds, 2 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-4-propan-2-ylbenzene;4-tert-butyl-2-chloro-1-fluorobenzene;4-tert-butyl-1-fluoro-2-methoxybenzene;1-chloro-4-propan-2-ylbenzene;2-cyclopentyl-1-fluoro-4-propan-2-ylbenzene;1,4-di(propan-2-yl)benzene;2-fluoro-5-propan-2-ylaniline;5-(2-fluoro-5-propan-2-ylphenyl)-3-methyl-1,2,4-oxadiazole;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-methoxy-4-propan-2-yl-2-(trifluoromethyl)benzene;methyl (E)-3-(2-fluoro-5-propan-2-ylphenyl)prop-2-enoate;1-methyl-4-propan-2-yl-2-(trifluoromethyl)benzene;(4-propan-2-ylphenyl)methanol is sourced from PubChem (CID 157094023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).