4-Benzoylbutyric Acid

Name: 4-Benzoylbutyric Acid
Brand: Vaqora Chemicals
SKU: VQ-049520

About 4-Benzoylbutyric Acid

4-Benzoylbutyric Acid (CAS 1501-05-9) is a process intermediate or related compound of Eletriptan offered by Vaqora Chemicals. Formula C11H12O3, molecular weight 192.21 g/mol. The IUPAC name is 5-oxo-5-phenylpentanoic acid. It is also known as Benzenepentanoic acid, delta-oxo- or delta-oxobenzenepentanoic acid.

It is supplied as a solid. Store the standard in its sealed vial, protected from light and moisture, and follow the storage condition printed on the COA. The GHS classification uses the signal word “Warning”, so appropriate gloves, eye protection and ventilation are recommended.

It is a process intermediate or related compound in the synthesis of Eletriptan, useful for route development, impurity fate-and-purge studies and analytical method development. Our customers for this product work in pharmaceutical manufacturing and academic and industrial research.

We offer 4-Benzoylbutyric Acid in 10 mg, 25 mg, 50 mg and 100 mg packs with a batch-specific COA, and ship to customers worldwide.

Typical applications

API route development
Impurity fate & purge studies
Analytical method development

Industries

Related to Eletriptan

View every impurity, metabolite and intermediate we list for Eletriptan.

Eletriptan impurities

Specifications & identifiers

Chemical identifiers
Product name	4-Benzoylbutyric Acid
Catalogue No.	VQ-049520
CAS Number	1501-05-9
IUPAC name	5-oxo-5-phenylpentanoic acid
Molecular formula	C₁₁H₁₂O₃
Molecular weight	192.21 g/mol
Exact mass	192.0786
InChIKey	SHKWSBAVRQZYLE-UHFFFAOYSA-N
SMILES	C1=CC=C(C=C1)C(=O)CCCC(=O)O
PubChem CID	73914

Physical properties
Physical form	Solid
LogP (XLogP3)	1.7
H-bond donors / acceptors	1 / 3
TPSA	54.4 Å²
Synonyms	Benzenepentanoic acid, delta-oxo-, delta-oxobenzenepentanoic acid, 5-Oxo-5-phenylvaleric acid, Benzenepentanoic acid, .delta.-oxo-, 4-benzoylbutyrate, 5-phenyl-5-oxopentanoic acid, 4-benzoylbutanoic acid, 5-oxo-5-phenyl-pentanoic acid, 5-keto-5-phenyl-valeric acid, Benzenepentanoic acid,, A-oxo-, 5-Oxo-5-phenylpentanoic acid #

Safety & hazard information (GHS)

Harmful / irritant

Signal word: Warning

Hazard statements

H315Causes skin irritation
H319Causes serious eye irritation
H335May cause respiratory irritation

Precautionary statements: P261, P264, P264 + P265, P271, P280, P302 + P352, P304 + P340, P305 + P351 + P338, P319, P321, P332 + P317, P337 + P317, P362 + P364, P403 + P233, P405, P501

Classification is indicative (aggregated GHS notifications) and may vary by grade and concentration. Always refer to the SDS supplied with your lot.

Documents

Safety Data Sheet (SDS)16-section GHS · on request Certificate of AnalysisTypical / batch COA · on request Specification sheetTDS / MOA · on request

Other grades of CAS 1501-05-9

LR

4-Benzoylbutyric acid, LR

CAS: 1501-05-9
Formula: C₁₁H₁₂O₃
MW: 192.21 g/mol

VQ-020579

Frequently asked questions

What is the CAS number of 4-Benzoylbutyric Acid?

The CAS Registry Number of 4-Benzoylbutyric Acid is 1501-05-9. It is also known as Benzenepentanoic acid, delta-oxo-, delta-oxobenzenepentanoic acid, 5-Oxo-5-phenylvaleric acid.

What is the molecular formula and molecular weight of 4-Benzoylbutyric Acid?

4-Benzoylbutyric Acid has the molecular formula C11H12O3 and a molecular weight of 192.21 g/mol. Its IUPAC name is 5-oxo-5-phenylpentanoic acid.

What is 4-Benzoylbutyric Acid used for?

4-Benzoylbutyric Acid is supplied as a characterised reference material related to Eletriptan. It is used for analytical method development and validation (AMV), impurity profiling, stability studies and quality control, and in ANDA/DMF regulatory filings.

Which grade and pack sizes of 4-Benzoylbutyric Acid can I order?

We supply 4-Benzoylbutyric Acid, in 10 mg, 25 mg, 50 mg, 100 mg packs. Larger bulk quantities and custom packing are quoted on request.

Do you provide a COA and SDS with 4-Benzoylbutyric Acid?

Yes. Every lot of 4-Benzoylbutyric Acid is shipped with a batch-specific Certificate of Analysis, and a 16-section GHS Safety Data Sheet is provided with the quotation and the shipment.

Can 4-Benzoylbutyric Acid be shipped internationally?

Yes. 4-Benzoylbutyric Acid is classified as hazardous, so it is packed in UN-approved packaging and shipped as dangerous goods under IATA/IMDG rules. We export worldwide on EXW, FOB, CIF and DAP terms.