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B12687 Sigma-Aldrich

5-Oxo-5-phenylvaleric acid

96%

Synonym: 4-Benzoylbutyric acid

  • CAS Number 1501-05-9

  • Linear Formula C6H5CO(CH2)3CO2H

  • Molecular Weight 192.21

  •  Beilstein/REAXYS Number 641947

  •  EC Number 216-113-5

  •  MDL number MFCD00004411

  •  PubChem Substance ID 24891576

  •  NACRES NA.22

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Properties

Related Categories Building Blocks, C11 to C12, Carbonyl Compounds, Carboxylic Acids, Chemical Synthesis,
Quality Level   100
assay   96%
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

Description

Packaging

10, 25 g in glass bottle

Safety & Documentation

Safety Information

Symbol 
GHS07  GHS07
Signal word 
Warning
Hazard statements 
Precautionary statements 
Target organs 
Respiratory system
Personal Protective Equipment 
RIDADR 
NONH for all modes of transport
WGK Germany 
WGK 3
Flash Point(F) 
Not applicable
Flash Point(C) 
Not applicable

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