1-[2-[(4,6-dinitro-1H-benzoimidazol-5-yl)amino]ethyl]imidazolidin-2-one

Modify Date: 2025-09-16 17:50:09

1-[2-[(4,6-dinitro-1H-benzoimidazol-5-yl)amino]ethyl]imidazolidin-2-one Structure
1-[2-[(4,6-dinitro-1H-benzoimidazol-5-yl)amino]ethyl]imidazolidin-2-one structure
Common Name 1-[2-[(4,6-dinitro-1H-benzoimidazol-5-yl)amino]ethyl]imidazolidin-2-one
CAS Number 72766-40-6 Molecular Weight 335.27600
Density 1.651g/cm3 Boiling Point 818.6ºC at 760 mmHg
Molecular Formula C12H13N7O5 Melting Point N/A
MSDS N/A Flash Point 448.9ºC

 Names

Name 1-[2-[(4,6-dinitro-1H-benzimidazol-5-yl)amino]ethyl]imidazolidin-2-one

 Chemical & Physical Properties

Density 1.651g/cm3
Boiling Point 818.6ºC at 760 mmHg
Molecular Formula C12H13N7O5
Molecular Weight 335.27600
Flash Point 448.9ºC
Exact Mass 335.09800
PSA 164.69000
LogP 2.20250
Index of Refraction 1.751
InChIKey TWIJWWZUONGTIY-UHFFFAOYSA-N
SMILES O=C1NCCN1CCNc1c([N+](=O)[O-])cc2[nH]cnc2c1[N+](=O)[O-]

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NJ0681500
CHEMICAL NAME :
2-Imidazolidinone, 1-(2-((4,6-dinitro-1H-benzimidazol-5-yl)amino)ethyl)-
CAS REGISTRY NUMBER :
72766-40-6
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H13-N7-O5
MOLECULAR WEIGHT :
335.32

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
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