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Structure

2-Phenylbutyric acid

CAS
90-27-7
Catalog Number
ACM90277
Category
Other Products
Molecular Weight
164.2
Molecular Formula
C10H12O2

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What is the PubChem CID for 2-Phenylbutyric acid?

PubChem CID 7012.

What is the molecular formula of 2-Phenylbutyric acid?

The molecular formula is C10H12O2.

What is the molecular weight of 2-Phenylbutyric acid?

The molecular weight is 164.20 g/mol.

What is the IUPAC name of 2-Phenylbutyric acid?

The IUPAC name is 2-phenylbutanoic acid.

What is the InChIKey of 2-Phenylbutyric acid?

The InChIKey is OFJWFSNDPCAWDK-UHFFFAOYSA-N.

What is the canonical SMILES representation of 2-Phenylbutyric acid?

The canonical SMILES is CCC(C1=CC=CC=C1)C(=O)O.

What is the CAS number of 2-Phenylbutyric acid?

The CAS number is 90-27-7.

What is the ChEMBL ID of 2-Phenylbutyric acid?

The ChEMBL ID is CHEMBL1616045.

What is the XLogP3-AA value of 2-Phenylbutyric acid?

The XLogP3-AA value is 2.3.

What is the hydrogen bond donor count of 2-Phenylbutyric acid?

The hydrogen bond donor count is 1.

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