B12687
5-Oxo-5-phenylvaleric acid
96%
Synonym(s):
4-Benzoylbutyric acid
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About This Item
Linear Formula:
C6H5CO(CH2)3CO2H
CAS Number:
Molecular Weight:
192.21
Beilstein/REAXYS Number:
641947
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
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Quality Level
assay
96%
form
powder
mp
126-129 °C (lit.)
SMILES string
OC(=O)CCCC(=O)c1ccccc1
InChI
1S/C11H12O3/c12-10(7-4-8-11(13)14)9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,13,14)
InChI key
SHKWSBAVRQZYLE-UHFFFAOYSA-N
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Related Categories
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
11 - Combustible Solids
wgk_germany
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
dust mask type N95 (US), Eyeshields, Gloves
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