1-(3-nitro-4-pentoxyphenyl)ethanone

Modify Date: 2025-09-25 11:08:43

1-(3-nitro-4-pentoxyphenyl)ethanone Structure
1-(3-nitro-4-pentoxyphenyl)ethanone structure
 Common Name 1-(3-nitro-4-pentoxyphenyl)ethanone
CAS Number 134221-17-3 Molecular Weight 251.27800
Density 1.127g/cm3 Boiling Point 369ºC at 760 mmHg
Molecular Formula C13H17NO4 Melting Point N/A
MSDS N/A Flash Point 150.4ºC

 Names

Name 1-(3-nitro-4-pentoxyphenyl)ethanone
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.127g/cm3
Boiling Point 369ºC at 760 mmHg
Molecular Formula C13H17NO4
Molecular Weight 251.27800
Flash Point 150.4ºC
Exact Mass 251.11600
PSA 72.12000
LogP 3.88960
Vapour Pressure 1.23E-05mmHg at 25°C
Index of Refraction 1.522
InChIKey AVKIIUSQUDFDIG-UHFFFAOYSA-N
SMILES CCCCCOc1ccc(C(C)=O)cc1[N+](=O)[O-]

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
KM5782520
CHEMICAL NAME :
Ethanone, 1-(3-nitro-4-(pentyloxy)phenyl)-
CAS REGISTRY NUMBER :
134221-17-3
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C13-H17-N-O4
MOLECULAR WEIGHT :
251.31

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>2 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
PCJOAU Pharmaceutical Chemistry Journal (English Translation). Translation of KHFZAN. (Plenum Pub. Corp., 233 Spring St., New York, NY 10013) No.1- 1967- Volume(issue)/page/year: 25,92,1991

 Synonyms

4-Amyloxy-3-nitroacetophenone
Ethanone,1-(3-nitro-4-(pentyloxy)phenyl)
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