methyl 4,4,4-trinitrobutanoate
Names
[ CAS No. ]:
5857-63-6
[ Name ]:
methyl 4,4,4-trinitrobutanoate
[Synonym ]:
4,4,4-Trinitrobutyric acid methyl ester
Butanoic acid,4,4,4-trinitro-,methyl ester
Butanoic acid,4,4,4-trinitro-,methyl ester (9CI)
Methyl 4,4,4-trinitrobutyrate
BUTYRIC ACID,4,4,4-TRINITRO-,METHYL ESTER
Chemical & Physical Properties
[ Molecular Formula ]:
C5H7N3O8
[ Molecular Weight ]:
237.12400
[ Exact Mass ]:
237.02300
[ PSA ]:
163.76000
[ LogP ]:
0.99310
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- ET6890000
- CHEMICAL NAME :
- Butyric acid, 4,4,4-trinitro-, methyl ester
- CAS REGISTRY NUMBER :
- 5857-63-6
- BEILSTEIN REFERENCE NO. :
- 1803027
- LAST UPDATED :
- 199712
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C5-H7-N3-O8
- MOLECULAR WEIGHT :
- 237.15
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Unreported
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 433 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- FATOAO Farmakologiya i Toksikologiya (Moscow). For English translation, see PHTXA6 and RPTOAN. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.2- 1939- Volume(issue)/page/year: 30,56,1967