[2,3-bis(4-methylphenyl)phenyl]methanol

C21H20O — CID 67427826

IUPAC[2,3-bis(4-methylphenyl)phenyl]methanol
SMILESCc1ccc(-c2cccc(CO)c2-c2ccc(C)cc2)cc1
InChIInChI=1S/C21H20O/c1-15-6-10-17(11-7-15)20-5-3-4-19(14-22)21(20)18-12-8-16(2)9-13-18/h3-13,22H,14H2,1-2H3
InChIKeyZRQIOJGFCHVBHB-UHFFFAOYSA-N
MW288.39 g/mol
LogP5.13
Rot. Bonds3

About [2,3-bis(4-methylphenyl)phenyl]methanol

[2,3-bis(4-methylphenyl)phenyl]methanol (PubChem CID 67427826) has the molecular formula C21H20O and a molecular weight of 288.39 g/mol. Its IUPAC name is [2,3-bis(4-methylphenyl)phenyl]methanol.

Molecular Properties

Compound Name[2,3-bis(4-methylphenyl)phenyl]methanol
PubChem CID67427826
Molecular FormulaC21H20O
Molecular Weight288.39 g/mol
Exact Mass288.15
IUPAC Name[2,3-bis(4-methylphenyl)phenyl]methanol
SMILESCc1ccc(-c2cccc(CO)c2-c2ccc(C)cc2)cc1
InChIInChI=1S/C21H20O/c1-15-6-10-17(11-7-15)20-5-3-4-19(14-22)21(20)18-12-8-16(2)9-13-18/h3-13,22H,14H2,1-2H3
InChIKeyZRQIOJGFCHVBHB-UHFFFAOYSA-N
XLogP5.13
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500288.39
LogP ≤ 55.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of [2,3-bis(4-methylphenyl)phenyl]methanol?
The IUPAC name of [2,3-bis(4-methylphenyl)phenyl]methanol (CID 67427826) is [2,3-bis(4-methylphenyl)phenyl]methanol.
What is the SMILES notation for [2,3-bis(4-methylphenyl)phenyl]methanol?
The canonical SMILES for [2,3-bis(4-methylphenyl)phenyl]methanol is Cc1ccc(-c2cccc(CO)c2-c2ccc(C)cc2)cc1.
What is the InChIKey of [2,3-bis(4-methylphenyl)phenyl]methanol?
The InChIKey is ZRQIOJGFCHVBHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20O/c1-15-6-10-17(11-7-15)20-5-3-4-19(14-22)21(20)18-12-8-16(2)9-13-18/h3-13,22H,14H2,1-2H3.
What are the key properties of [2,3-bis(4-methylphenyl)phenyl]methanol?
[2,3-bis(4-methylphenyl)phenyl]methanol has a molecular weight of 288.39 g/mol, XLogP of 5.13, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2,3-bis(4-methylphenyl)phenyl]methanol is sourced from PubChem (CID 67427826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).