2-hydroxy-3-methyl-4-(2-phenylphenyl)benzoic acid

C20H16O3 — CID 19102967

IUPAC2-hydroxy-3-methyl-4-(2-phenylphenyl)benzoic acid
SMILESCc1c(-c2ccccc2-c2ccccc2)ccc(C(=O)O)c1O
InChIInChI=1S/C20H16O3/c1-13-15(11-12-18(19(13)21)20(22)23)17-10-6-5-9-16(17)14-7-3-2-4-8-14/h2-12,21H,1H3,(H,22,23)
InChIKeyYSPVKMWLULNVMV-UHFFFAOYSA-N
MW304.35 g/mol
LogP4.73
Rot. Bonds3

About 2-hydroxy-3-methyl-4-(2-phenylphenyl)benzoic acid

2-hydroxy-3-methyl-4-(2-phenylphenyl)benzoic acid (PubChem CID 19102967) has the molecular formula C20H16O3 and a molecular weight of 304.35 g/mol. Its IUPAC name is 2-hydroxy-3-methyl-4-(2-phenylphenyl)benzoic acid.

Molecular Properties

Compound Name2-hydroxy-3-methyl-4-(2-phenylphenyl)benzoic acid
PubChem CID19102967
Molecular FormulaC20H16O3
Molecular Weight304.35 g/mol
Exact Mass304.11
IUPAC Name2-hydroxy-3-methyl-4-(2-phenylphenyl)benzoic acid
SMILESCc1c(-c2ccccc2-c2ccccc2)ccc(C(=O)O)c1O
InChIInChI=1S/C20H16O3/c1-13-15(11-12-18(19(13)21)20(22)23)17-10-6-5-9-16(17)14-7-3-2-4-8-14/h2-12,21H,1H3,(H,22,23)
InChIKeyYSPVKMWLULNVMV-UHFFFAOYSA-N
XLogP4.73
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 54.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-hydroxy-3-(2-phenylphenyl)benzoic acid
CID 67822406
2-[2-(2-phenylphenyl)phenyl]benzoic acid
CID 141238749
2-methyl-3,4-diphenylbenzoic acid
CID 118554966
2-hydroxy-3-phenylbenzoic acid;hydrate
CID 141168272
2-methyl-4-phenylbenzene-1,3-dicarboxylic acid;propan-2-one
CID 157214158
2-hydroxy-4-methyl-3-phenylbenzoic acid
CID 71254300
2-(2-phenylphenyl)terephthalic acid
CID 67851740
2-methyl-4-phenyl-3-(trifluoromethyl)benzoic acid
CID 67541759
2-hydroxy-5-methyl-3-phenylbenzoic acid;zinc
CID 58652419
3-(3-carboxy-2-methylphenyl)-2-methylbenzoic acid
CID 22140374
6-amino-2-methyl-3-phenylphenol
CID 175328726
2-butyl-3-methyl-4-phenylbenzoic acid
CID 175125661

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-3-methyl-4-(2-phenylphenyl)benzoic acid?
The IUPAC name of 2-hydroxy-3-methyl-4-(2-phenylphenyl)benzoic acid (CID 19102967) is 2-hydroxy-3-methyl-4-(2-phenylphenyl)benzoic acid.
What is the SMILES notation for 2-hydroxy-3-methyl-4-(2-phenylphenyl)benzoic acid?
The canonical SMILES for 2-hydroxy-3-methyl-4-(2-phenylphenyl)benzoic acid is Cc1c(-c2ccccc2-c2ccccc2)ccc(C(=O)O)c1O.
What is the InChIKey of 2-hydroxy-3-methyl-4-(2-phenylphenyl)benzoic acid?
The InChIKey is YSPVKMWLULNVMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16O3/c1-13-15(11-12-18(19(13)21)20(22)23)17-10-6-5-9-16(17)14-7-3-2-4-8-14/h2-12,21H,1H3,(H,22,23).
What are the key properties of 2-hydroxy-3-methyl-4-(2-phenylphenyl)benzoic acid?
2-hydroxy-3-methyl-4-(2-phenylphenyl)benzoic acid has a molecular weight of 304.35 g/mol, XLogP of 4.73, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-3-methyl-4-(2-phenylphenyl)benzoic acid is sourced from PubChem (CID 19102967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).