2-[3-(3-hydroxyphenyl)phenyl]propanoic acid

C15H14O3 — CID 176514338

IUPAC2-[3-(3-hydroxyphenyl)phenyl]propanoic acid
SMILESCC(C(=O)O)c1cccc(-c2cccc(O)c2)c1
InChIInChI=1S/C15H14O3/c1-10(15(17)18)11-4-2-5-12(8-11)13-6-3-7-14(16)9-13/h2-10,16H,1H3,(H,17,18)
InChIKeyGOEWAMXINVCZNP-UHFFFAOYSA-N
MW242.27 g/mol
LogP3.25
Rot. Bonds3

About 2-[3-(3-hydroxyphenyl)phenyl]propanoic acid

2-[3-(3-hydroxyphenyl)phenyl]propanoic acid (PubChem CID 176514338) has the molecular formula C15H14O3 and a molecular weight of 242.27 g/mol. Its IUPAC name is 2-[3-(3-hydroxyphenyl)phenyl]propanoic acid.

Molecular Properties

Compound Name2-[3-(3-hydroxyphenyl)phenyl]propanoic acid
PubChem CID176514338
Molecular FormulaC15H14O3
Molecular Weight242.27 g/mol
Exact Mass242.09
IUPAC Name2-[3-(3-hydroxyphenyl)phenyl]propanoic acid
SMILESCC(C(=O)O)c1cccc(-c2cccc(O)c2)c1
InChIInChI=1S/C15H14O3/c1-10(15(17)18)11-4-2-5-12(8-11)13-6-3-7-14(16)9-13/h2-10,16H,1H3,(H,17,18)
InChIKeyGOEWAMXINVCZNP-UHFFFAOYSA-N
XLogP3.25
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.27
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[3-(3-ethylphenyl)phenyl]propanoic acid
CID 176514342
2-[3-(difluoromethyl)phenyl]propanoic acid
CID 84669259
2-(3-benzoylphenyl)propanoic acid;phenol
CID 161129325
2-[3-[3-(trifluoromethoxy)phenyl]phenyl]propanoic acid
CID 176514336
3-[(1S)-1-carboxyethyl]benzoic acid
CID 71587871
2-[3-(2,5-diaminophenyl)phenyl]propanoic acid
CID 70164461
2-[3-[(S)-hydroxy(phenyl)methyl]phenyl]propanoic acid
CID 67709050
2-[3-(3-chloro-2-fluorophenyl)phenyl]propanoic acid
CID 176514361
benzene-1,3-diol;2-[4-(2-methylpropyl)phenyl]propanoic acid
CID 70397497
2-phenylpropanoic acid;hydrate
CID 139796091
methane;(2R)-2-phenylpropanoic acid
CID 162174165
2-phenylpropanoic acid;dihydrochloride
CID 162109025

Frequently Asked Questions

What is the IUPAC name of 2-[3-(3-hydroxyphenyl)phenyl]propanoic acid?
The IUPAC name of 2-[3-(3-hydroxyphenyl)phenyl]propanoic acid (CID 176514338) is 2-[3-(3-hydroxyphenyl)phenyl]propanoic acid.
What is the SMILES notation for 2-[3-(3-hydroxyphenyl)phenyl]propanoic acid?
The canonical SMILES for 2-[3-(3-hydroxyphenyl)phenyl]propanoic acid is CC(C(=O)O)c1cccc(-c2cccc(O)c2)c1.
What is the InChIKey of 2-[3-(3-hydroxyphenyl)phenyl]propanoic acid?
The InChIKey is GOEWAMXINVCZNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14O3/c1-10(15(17)18)11-4-2-5-12(8-11)13-6-3-7-14(16)9-13/h2-10,16H,1H3,(H,17,18).
What are the key properties of 2-[3-(3-hydroxyphenyl)phenyl]propanoic acid?
2-[3-(3-hydroxyphenyl)phenyl]propanoic acid has a molecular weight of 242.27 g/mol, XLogP of 3.25, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(3-hydroxyphenyl)phenyl]propanoic acid is sourced from PubChem (CID 176514338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).