DEN – diethyl nitrosamine

Name
WID DEN View in model
Name diethyl nitrosamine View in model
Traditional name DANA
IUPAC name diethyl(nitroso)amine
Cross references PubChem: 11533729, ChEBI: 34873, KEGG: C14422
 
Classification
Type alkylating_agent_ethylation View in model
 
Structure
Empirical formula (pH 7.5) H10C4N2O1
SMILES (pH 7.5) CCN(CC)N=O
Charge (pH 7.5) 0
Is hydrophobic False View in model
Molecular weight (Da) 102.13 View in model
van der Waals volume 
(pH 7.5; Å3 molecule‑1)
106.58
ΔfG'o (pH 7.5, 25C, I = 0; kJ mol‑1) 0.0
logP 0.750
logD (pH 7.5) 0.750
 
Comments
Comments DNA methylating agent [PUB_0467]
References
  1. Beranek DT. Distribution of methyl and ethyl adducts following alkylation with monofunctional alkylating agents. Mutat Res 231, 11-30 (1990). WholeCell: PUB_0467, PubMed: 2195323

 
Metadata
Created 2012-10-01 15:06:54
Last updated 2012-10-01 15:12:02