(2R)-2-(4-chlorophenyl)-2-phenylacetic acid

C14H11ClO2 — CID 7009399

IUPAC(2R)-2-(4-chlorophenyl)-2-phenylacetic acid
SMILESO=C(O)[C@H](c1ccccc1)c1ccc(Cl)cc1
InChIInChI=1S/C14H11ClO2/c15-12-8-6-11(7-9-12)13(14(16)17)10-4-2-1-3-5-10/h1-9,13H,(H,16,17)/t13-/m1/s1
InChIKeyYSPUGNBNEKEGKB-CYBMUJFWSA-N
MW246.69 g/mol
LogP3.56
Rot. Bonds3

About (2R)-2-(4-chlorophenyl)-2-phenylacetic acid

(2R)-2-(4-chlorophenyl)-2-phenylacetic acid (PubChem CID 7009399) has the molecular formula C14H11ClO2 and a molecular weight of 246.69 g/mol. Its IUPAC name is (2R)-2-(4-chlorophenyl)-2-phenylacetic acid.

Molecular Properties

Compound Name(2R)-2-(4-chlorophenyl)-2-phenylacetic acid
PubChem CID7009399
Molecular FormulaC14H11ClO2
Molecular Weight246.69 g/mol
Exact Mass246.04
IUPAC Name(2R)-2-(4-chlorophenyl)-2-phenylacetic acid
SMILESO=C(O)[C@H](c1ccccc1)c1ccc(Cl)cc1
InChIInChI=1S/C14H11ClO2/c15-12-8-6-11(7-9-12)13(14(16)17)10-4-2-1-3-5-10/h1-9,13H,(H,16,17)/t13-/m1/s1
InChIKeyYSPUGNBNEKEGKB-CYBMUJFWSA-N
XLogP3.56
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.69
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-chlorophenyl)-2-phenylacetic acid?
The IUPAC name of (2R)-2-(4-chlorophenyl)-2-phenylacetic acid (CID 7009399) is (2R)-2-(4-chlorophenyl)-2-phenylacetic acid.
What is the SMILES notation for (2R)-2-(4-chlorophenyl)-2-phenylacetic acid?
The canonical SMILES for (2R)-2-(4-chlorophenyl)-2-phenylacetic acid is O=C(O)[C@H](c1ccccc1)c1ccc(Cl)cc1.
What is the InChIKey of (2R)-2-(4-chlorophenyl)-2-phenylacetic acid?
The InChIKey is YSPUGNBNEKEGKB-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H11ClO2/c15-12-8-6-11(7-9-12)13(14(16)17)10-4-2-1-3-5-10/h1-9,13H,(H,16,17)/t13-/m1/s1.
What are the key properties of (2R)-2-(4-chlorophenyl)-2-phenylacetic acid?
(2R)-2-(4-chlorophenyl)-2-phenylacetic acid has a molecular weight of 246.69 g/mol, XLogP of 3.56, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-chlorophenyl)-2-phenylacetic acid is sourced from PubChem (CID 7009399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).