4,6-Dinitro-2-methyl-5-(1-piperidinyl)-1H-benzimidazole

Modify Date: 2025-09-23 19:33:01

4,6-Dinitro-2-methyl-5-(1-piperidinyl)-1H-benzimidazole Structure
4,6-Dinitro-2-methyl-5-(1-piperidinyl)-1H-benzimidazole structure
Common Name 4,6-Dinitro-2-methyl-5-(1-piperidinyl)-1H-benzimidazole
CAS Number 72766-19-9 Molecular Weight 305.28900
Density 1.472g/cm3 Boiling Point 574.5ºC at 760 mmHg
Molecular Formula C13H15N5O4 Melting Point N/A
MSDS N/A Flash Point 301.2ºC

 Names

Name 2-methyl-4,6-dinitro-5-piperidin-1-yl-1H-benzimidazole
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.472g/cm3
Boiling Point 574.5ºC at 760 mmHg
Molecular Formula C13H15N5O4
Molecular Weight 305.28900
Flash Point 301.2ºC
Exact Mass 305.11200
PSA 123.56000
LogP 3.78940
Index of Refraction 1.691
InChIKey IGCKSSGGIKBOHB-UHFFFAOYSA-N
SMILES Cc1nc2c([N+](=O)[O-])c(N3CCCCC3)c([N+](=O)[O-])cc2[nH]1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DD8790055
CHEMICAL NAME :
1H-Benzimidazole, 4,6-dinitro-2-methyl-5-(1-piperidinyl)-
CAS REGISTRY NUMBER :
72766-19-9
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C13-H15-N5-O4
MOLECULAR WEIGHT :
305.33

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Unreported
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>1 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
IJSBDB Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. (Publications & Information Directorate, Council of Scientific and Industrial Research (CSIR), Hillside Rd., New Delhi 110 012, India) V.14B- 1976- Volume(issue)/page/year: 17,164,1979

 Synonyms

2-Methyl-4,6-dinitro-5-piperidinobenzimidazol
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