Hexamethylenimine, N-[(4-chloro-3-nitrobenzylidene)amino]-

Modify Date: 2025-08-25 18:16:14

Hexamethylenimine, N-[(4-chloro-3-nitrobenzylidene)amino]- Structure
Hexamethylenimine, N-[(4-chloro-3-nitrobenzylidene)amino]- structure
Common Name Hexamethylenimine, N-[(4-chloro-3-nitrobenzylidene)amino]-
CAS Number 73855-79-5 Molecular Weight 281.73800
Density 1.3g/cm3 Boiling Point 437.2ºC at 760 mmHg
Molecular Formula C13H16ClN3O2 Melting Point N/A
MSDS N/A Flash Point 218.2ºC

 Names

Name (E)-N-(azepan-1-yl)-1-(4-chloro-3-nitrophenyl)methanimine
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.3g/cm3
Boiling Point 437.2ºC at 760 mmHg
Molecular Formula C13H16ClN3O2
Molecular Weight 281.73800
Flash Point 218.2ºC
Exact Mass 281.09300
PSA 61.42000
LogP 3.91920
Index of Refraction 1.61
InChIKey RSUACCCXPXYDJT-XNTDXEJSSA-N
SMILES O=[N+]([O-])c1cc(C=NN2CCCCCC2)ccc1Cl

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CM3000000
CHEMICAL NAME :
1H-Azepine, 1-((4-chloro-3-nitrobenzylidene)amino)hexahydro-
CAS REGISTRY NUMBER :
73855-79-5
LAST UPDATED :
197901
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C13-H16-Cl-N3-O2
MOLECULAR WEIGHT :
281.77
WISWESSER LINE NOTATION :
T7NTJ ANU1R DG CNW

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
180 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#02713

 Synonyms

1H-AZEPINE,1-((4-CHLORO-3-NITROBENZYLIDENE)AMINO)HEXAHYDRO
Hexamethylenimine,N-((4-chloro-3-nitrobenzylidene)amino)
1H-Azepin-1-amine,N-((4-chloro-3-nitrophenyl)methylene)hexahydro
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