(5-chloro-2-methylphenyl)-(2,4,6-trimethylphenyl)methanol

C17H19ClO — CID 82883722

IUPAC(5-chloro-2-methylphenyl)-(2,4,6-trimethylphenyl)methanol
SMILESCc1cc(C)c(C(O)c2cc(Cl)ccc2C)c(C)c1
InChIInChI=1S/C17H19ClO/c1-10-7-12(3)16(13(4)8-10)17(19)15-9-14(18)6-5-11(15)2/h5-9,17,19H,1-4H3
InChIKeyNXCBNICKMJSCEC-UHFFFAOYSA-N
MW274.79 g/mol
LogP4.66
Rot. Bonds2

About (5-chloro-2-methylphenyl)-(2,4,6-trimethylphenyl)methanol

(5-chloro-2-methylphenyl)-(2,4,6-trimethylphenyl)methanol (PubChem CID 82883722) has the molecular formula C17H19ClO and a molecular weight of 274.79 g/mol. Its IUPAC name is (5-chloro-2-methylphenyl)-(2,4,6-trimethylphenyl)methanol.

Molecular Properties

Compound Name(5-chloro-2-methylphenyl)-(2,4,6-trimethylphenyl)methanol
PubChem CID82883722
Molecular FormulaC17H19ClO
Molecular Weight274.79 g/mol
Exact Mass274.11
IUPAC Name(5-chloro-2-methylphenyl)-(2,4,6-trimethylphenyl)methanol
SMILESCc1cc(C)c(C(O)c2cc(Cl)ccc2C)c(C)c1
InChIInChI=1S/C17H19ClO/c1-10-7-12(3)16(13(4)8-10)17(19)15-9-14(18)6-5-11(15)2/h5-9,17,19H,1-4H3
InChIKeyNXCBNICKMJSCEC-UHFFFAOYSA-N
XLogP4.66
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.79
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(5-chloro-2-methylphenyl)-(2,4,6-trifluorophenyl)methanol
CID 82883112
(2,5-dichlorophenyl)-(2-fluoro-4,6-dimethylphenyl)methanol
CID 106884176
(2,5-dichlorophenyl)-(4-fluoro-2,6-dimethylphenyl)methanol
CID 106879574
(2-chloro-4,5-dimethylphenyl)-(2,4,6-trimethylphenyl)methanol
CID 115484494
(4-chloro-2-fluorophenyl)-(2-methoxy-4,6-dimethylphenyl)methanol
CID 106679789
1-(5-chloro-2-methylphenyl)-2-ethylbutan-1-ol
CID 115821957
(5-chloro-2-methoxyphenyl)-(4-fluoro-2,6-dimethylphenyl)methanol
CID 106879586
(5-chloro-2-methylphenyl)-(2,3-difluorophenyl)methanol
CID 115800933
(1S,2R)-2-amino-1-(5-chloro-2-methylphenyl)propan-1-ol
CID 131146815
(1R,2R)-1-amino-1-(5-chloro-2-methylphenyl)propan-2-ol
CID 130778314
(1S,2R)-1-amino-1-(5-chloro-2-methylphenyl)propan-2-ol
CID 130742251
(S)-(3-bromophenyl)-(5-chloro-2-methylphenyl)methanol
CID 97293534

Frequently Asked Questions

What is the IUPAC name of (5-chloro-2-methylphenyl)-(2,4,6-trimethylphenyl)methanol?
The IUPAC name of (5-chloro-2-methylphenyl)-(2,4,6-trimethylphenyl)methanol (CID 82883722) is (5-chloro-2-methylphenyl)-(2,4,6-trimethylphenyl)methanol.
What is the SMILES notation for (5-chloro-2-methylphenyl)-(2,4,6-trimethylphenyl)methanol?
The canonical SMILES for (5-chloro-2-methylphenyl)-(2,4,6-trimethylphenyl)methanol is Cc1cc(C)c(C(O)c2cc(Cl)ccc2C)c(C)c1.
What is the InChIKey of (5-chloro-2-methylphenyl)-(2,4,6-trimethylphenyl)methanol?
The InChIKey is NXCBNICKMJSCEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19ClO/c1-10-7-12(3)16(13(4)8-10)17(19)15-9-14(18)6-5-11(15)2/h5-9,17,19H,1-4H3.
What are the key properties of (5-chloro-2-methylphenyl)-(2,4,6-trimethylphenyl)methanol?
(5-chloro-2-methylphenyl)-(2,4,6-trimethylphenyl)methanol has a molecular weight of 274.79 g/mol, XLogP of 4.66, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chloro-2-methylphenyl)-(2,4,6-trimethylphenyl)methanol is sourced from PubChem (CID 82883722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).