(2-chlorophenyl)-(4-methylphenyl)-phenylmethanol

C20H17ClO — CID 51340415

IUPAC(2-chlorophenyl)-(4-methylphenyl)-phenylmethanol
SMILESCc1ccc(C(O)(c2ccccc2)c2ccccc2Cl)cc1
InChIInChI=1S/C20H17ClO/c1-15-11-13-17(14-12-15)20(22,16-7-3-2-4-8-16)18-9-5-6-10-19(18)21/h2-14,22H,1H3
InChIKeyKQBKGXQZIWYULN-UHFFFAOYSA-N
MW308.81 g/mol
LogP4.93
Rot. Bonds3

About (2-chlorophenyl)-(4-methylphenyl)-phenylmethanol

(2-chlorophenyl)-(4-methylphenyl)-phenylmethanol (PubChem CID 51340415) has the molecular formula C20H17ClO and a molecular weight of 308.81 g/mol. Its IUPAC name is (2-chlorophenyl)-(4-methylphenyl)-phenylmethanol.

Molecular Properties

Compound Name(2-chlorophenyl)-(4-methylphenyl)-phenylmethanol
PubChem CID51340415
Molecular FormulaC20H17ClO
Molecular Weight308.81 g/mol
Exact Mass308.10
IUPAC Name(2-chlorophenyl)-(4-methylphenyl)-phenylmethanol
SMILESCc1ccc(C(O)(c2ccccc2)c2ccccc2Cl)cc1
InChIInChI=1S/C20H17ClO/c1-15-11-13-17(14-12-15)20(22,16-7-3-2-4-8-16)18-9-5-6-10-19(18)21/h2-14,22H,1H3
InChIKeyKQBKGXQZIWYULN-UHFFFAOYSA-N
XLogP4.93
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.81
LogP ≤ 54.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2-chlorophenyl)-(4-methylphenyl)-phenylmethanol?
The IUPAC name of (2-chlorophenyl)-(4-methylphenyl)-phenylmethanol (CID 51340415) is (2-chlorophenyl)-(4-methylphenyl)-phenylmethanol.
What is the SMILES notation for (2-chlorophenyl)-(4-methylphenyl)-phenylmethanol?
The canonical SMILES for (2-chlorophenyl)-(4-methylphenyl)-phenylmethanol is Cc1ccc(C(O)(c2ccccc2)c2ccccc2Cl)cc1.
What is the InChIKey of (2-chlorophenyl)-(4-methylphenyl)-phenylmethanol?
The InChIKey is KQBKGXQZIWYULN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17ClO/c1-15-11-13-17(14-12-15)20(22,16-7-3-2-4-8-16)18-9-5-6-10-19(18)21/h2-14,22H,1H3.
What are the key properties of (2-chlorophenyl)-(4-methylphenyl)-phenylmethanol?
(2-chlorophenyl)-(4-methylphenyl)-phenylmethanol has a molecular weight of 308.81 g/mol, XLogP of 4.93, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chlorophenyl)-(4-methylphenyl)-phenylmethanol is sourced from PubChem (CID 51340415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).