2-[4-(4-chlorophenyl)phenyl]-2-hydroxyacetic acid

C14H11ClO3 — CID 19793104

IUPAC2-[4-(4-chlorophenyl)phenyl]-2-hydroxyacetic acid
SMILESO=C(O)C(O)c1ccc(-c2ccc(Cl)cc2)cc1
InChIInChI=1S/C14H11ClO3/c15-12-7-5-10(6-8-12)9-1-3-11(4-2-9)13(16)14(17)18/h1-8,13,16H,(H,17,18)
InChIKeyXJOFOZMJYXIDMS-UHFFFAOYSA-N
MW262.69 g/mol
LogP3.12
Rot. Bonds3

About 2-[4-(4-chlorophenyl)phenyl]-2-hydroxyacetic acid

2-[4-(4-chlorophenyl)phenyl]-2-hydroxyacetic acid (PubChem CID 19793104) has the molecular formula C14H11ClO3 and a molecular weight of 262.69 g/mol. Its IUPAC name is 2-[4-(4-chlorophenyl)phenyl]-2-hydroxyacetic acid.

Molecular Properties

Compound Name2-[4-(4-chlorophenyl)phenyl]-2-hydroxyacetic acid
PubChem CID19793104
Molecular FormulaC14H11ClO3
Molecular Weight262.69 g/mol
Exact Mass262.04
IUPAC Name2-[4-(4-chlorophenyl)phenyl]-2-hydroxyacetic acid
SMILESO=C(O)C(O)c1ccc(-c2ccc(Cl)cc2)cc1
InChIInChI=1S/C14H11ClO3/c15-12-7-5-10(6-8-12)9-1-3-11(4-2-9)13(16)14(17)18/h1-8,13,16H,(H,17,18)
InChIKeyXJOFOZMJYXIDMS-UHFFFAOYSA-N
XLogP3.12
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.69
LogP ≤ 53.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-(4-chlorophenyl)-2-hydroxyacetic acid
CID 785083
(2S)-2-aminopropanoic acid;2-(4-chlorophenyl)-2-hydroxyacetic acid
CID 70537702
2-[4-(2,5-dichlorophenyl)phenyl]-2-hydroxyacetic acid
CID 82040010
(2R)-2-(4-chlorophenyl)-2-hydroxyacetamide
CID 69300221
2-[4-(4-chlorophenyl)phenyl]-2-methoxyacetic acid
CID 70572133
[4-(4-chlorophenyl)phenyl]-(trihydroxy-λ4-sulfanyl)methanol
CID 18683751
(2R)-2-hydroxy-2-phenylacetic acid
CID 139040954
2-((1,2,3,4,5,6-13C6)cyclohexatrienyl)-2-hydroxyacetic acid
CID 11019130
CID 70480259
CID 70480259
2-[4-(3,5-dichlorophenyl)-3-fluorophenyl]-2-hydroxyacetic acid
CID 134633828
4-(4-chlorophenyl)-N-[(2R)-2-hydroxy-2-phenylacetyl]benzamide
CID 22872207
(2S)-2-hydroxy-2-phenylacetic acid;hydrochloride
CID 141322731

Frequently Asked Questions

What is the IUPAC name of 2-[4-(4-chlorophenyl)phenyl]-2-hydroxyacetic acid?
The IUPAC name of 2-[4-(4-chlorophenyl)phenyl]-2-hydroxyacetic acid (CID 19793104) is 2-[4-(4-chlorophenyl)phenyl]-2-hydroxyacetic acid.
What is the SMILES notation for 2-[4-(4-chlorophenyl)phenyl]-2-hydroxyacetic acid?
The canonical SMILES for 2-[4-(4-chlorophenyl)phenyl]-2-hydroxyacetic acid is O=C(O)C(O)c1ccc(-c2ccc(Cl)cc2)cc1.
What is the InChIKey of 2-[4-(4-chlorophenyl)phenyl]-2-hydroxyacetic acid?
The InChIKey is XJOFOZMJYXIDMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClO3/c15-12-7-5-10(6-8-12)9-1-3-11(4-2-9)13(16)14(17)18/h1-8,13,16H,(H,17,18).
What are the key properties of 2-[4-(4-chlorophenyl)phenyl]-2-hydroxyacetic acid?
2-[4-(4-chlorophenyl)phenyl]-2-hydroxyacetic acid has a molecular weight of 262.69 g/mol, XLogP of 3.12, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4-chlorophenyl)phenyl]-2-hydroxyacetic acid is sourced from PubChem (CID 19793104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).