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B13802

3-Benzoylpropionic acid

Name: 3-Benzoylpropionic acid
Brand: ALDRICH

99%

Synonym(s):

4-Oxo-4-phenylbutyric acid

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About This Item

Linear Formula:

C₆H₅COCH₂CH₂COOH

CAS Number:

2051-95-8

Molecular Weight:

178.18

UNSPSC Code:

12352100

NACRES:

NA.22

PubChem Substance ID:

24891586

EC Number:

218-135-0

Beilstein/REAXYS Number:

639757

MDL number:

MFCD00002792

Assay:

99%

Form:

crystals

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Properties

Quality Level

100

assay

99%

form

crystals

mp

114-117 °C (lit.)

SMILES string

OC(=O)CCC(=O)c1ccccc1

InChI

1S/C10H10O3/c11-9(6-7-10(12)13)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,12,13)

InChI key

KMQLIDDEQAJAGJ-UHFFFAOYSA-N

Description

pictograms

GHS07

signalword

Warning

hcodes

H315,H319,H335

pcodes

P261 - P264 - P271 - P280 - P302 + P352 - P305 + P351 + P338

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves

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Substituted hippurates and hippurate analogs as substrates and inhibitors of peptidylglycine alpha-hydroxylating monooxygenase (PHM).

David J Merkler et al.

Bioorganic & medicinal chemistry, 16(23), 10061-10074 (2008-10-28)

Peptidyl alpha-hydroxylating monooxygenase (PHM) functions in vivo towards the biosynthesis of alpha-amidated peptide hormones in mammals and insects. PHM is a potential target for the development of inhibitors as drugs for the treatment of human disease and as insecticides for

Global Trade Item Number

SKU	GTIN
B13802-100G	04061838352439
B13802-25G	04061831823622