4-(4-Nitrophenyl)-4-oxo-2-hydroxybutanoic acid

Modify Date: 2025-09-22 19:09:48

4-(4-Nitrophenyl)-4-oxo-2-hydroxybutanoic acid Structure
4-(4-Nitrophenyl)-4-oxo-2-hydroxybutanoic acid structure
 Common Name 4-(4-Nitrophenyl)-4-oxo-2-hydroxybutanoic acid
CAS Number 81008-13-1 Molecular Weight 239.18200
Density 1.51g/cm3 Boiling Point 520.9ºC at 760 mmHg
Molecular Formula C10H9NO6 Melting Point N/A
MSDS N/A Flash Point 228ºC

 Names

Name 2-Hydroxy-4-(4-nitrophenyl)-4-oxobutanoic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.51g/cm3
Boiling Point 520.9ºC at 760 mmHg
Molecular Formula C10H9NO6
Molecular Weight 239.18200
Flash Point 228ºC
Exact Mass 239.04300
PSA 120.42000
LogP 1.13630
Index of Refraction 1.613
InChIKey MMFZQNVAJIAIDO-UHFFFAOYSA-N
SMILES O=C(CC(O)C(=O)O)c1ccc([N+](=O)[O-])cc1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CY9052200
CHEMICAL NAME :
Benzenebutanoic acid, alpha-hydroxy-4-nitro-gamma-oxo-
CAS REGISTRY NUMBER :
81008-13-1
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C10-H9-N-O6
MOLECULAR WEIGHT :
239.20

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>1 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
BAXXDU British UK Patent Application. (U.S. Patent and Trademark Office, Foreign Patents, Washington, DC 20231) Volume(issue)/page/year: #2074575

 Synonyms

4-(4-Nitrophenyl)-4-oxo-2-hydroxybutanoic acid
Benzenebutanoic acid,a-hydroxy-4-nitro-g-oxo
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Chemsrc provides CAS#:81008-13-1 MSDS, density, melting point, boiling point, structure, etc. Its name is 4-(4-Nitrophenyl)-4-oxo-2-hydroxybutanoic acid>> amp version: 4-(4-Nitrophenyl)-4-oxo-2-hydroxybutanoic acid

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