N-((N,N-dimethylamino)ethyl)-5-(N,N-bis(2-chloroethyl)amino)-2,4-dinitrobenzamide

Modify Date: 2025-09-24 09:47:47

N-((N,N-dimethylamino)ethyl)-5-(N,N-bis(2-chloroethyl)amino)-2,4-dinitrobenzamide Structure
N-((N,N-dimethylamino)ethyl)-5-(N,N-bis(2-chloroethyl)amino)-2,4-dinitrobenzamide structure
Common Name N-((N,N-dimethylamino)ethyl)-5-(N,N-bis(2-chloroethyl)amino)-2,4-dinitrobenzamide
CAS Number 142439-63-2 Molecular Weight 422.26400
Density 1.388g/cm3 Boiling Point 557ºC at 760mmHg
Molecular Formula C15H21Cl2N5O5 Melting Point N/A
MSDS N/A Flash Point 290.6ºC

 Names

Name 5-[bis(2-chloroethyl)amino]-N-[2-(dimethylamino)ethyl]-2,4-dinitrobenzamide
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.388g/cm3
Boiling Point 557ºC at 760mmHg
Molecular Formula C15H21Cl2N5O5
Molecular Weight 422.26400
Flash Point 290.6ºC
Exact Mass 421.09200
PSA 130.71000
LogP 3.69960
Vapour Pressure 1.93E-12mmHg at 25°C
Index of Refraction 1.599
InChIKey KHXWXJZPAQGKDJ-UHFFFAOYSA-N
SMILES CN(C)CCNC(=O)c1cc(N(CCCl)CCCl)c([N+](=O)[O-])cc1[N+](=O)[O-]

 Synthetic Route

~57%

N-((N,N-dimethylamino)ethyl)-5-(N,N-bis(2-chloroethyl)amino)-2,4-dinitrobenzamide Structure

N-((N,N-dimethy...

CAS#:142439-63-2

Literature: Palmer, Brian D.; Wilson, William R.; Cliffe, Stephen; Denny, William A. Journal of Medicinal Chemistry, 1992 , vol. 35, # 17 p. 3214 - 3222

~%

N-((N,N-dimethylamino)ethyl)-5-(N,N-bis(2-chloroethyl)amino)-2,4-dinitrobenzamide Structure

N-((N,N-dimethy...

CAS#:142439-63-2

Literature: Palmer, Brian D.; Wilson, William R.; Cliffe, Stephen; Denny, William A. Journal of Medicinal Chemistry, 1992 , vol. 35, # 17 p. 3214 - 3222

~%

N-((N,N-dimethylamino)ethyl)-5-(N,N-bis(2-chloroethyl)amino)-2,4-dinitrobenzamide Structure

N-((N,N-dimethy...

CAS#:142439-63-2

Literature: Palmer, Brian D.; Wilson, William R.; Cliffe, Stephen; Denny, William A. Journal of Medicinal Chemistry, 1992 , vol. 35, # 17 p. 3214 - 3222

 Synonyms

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