methyl N-(2-chloroethyl)-N-nitrosocarbamate

CAS: 13589-15-6

Molecular Formula	`C4H7ClN2O3`
Molecular Weight	166.56 g/mol
LogP	1.0
Topological Polar Surface Area	59.0 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	4
Rotatable Bonds	3
Exact Mass	166.01453
Heavy Atoms	10
Complexity	130.0

Chemical Identifiers

CAS Number	13589-15-6
SMILES	`COC(=O)N(CCCl)N=O`
InChIKey	`ZIVWROYTZSSKDC-UHFFFAOYSA-N`

📖 Product Overview

methyl N-(2-chloroethyl)-N-nitrosocarbamate (CAS: 13589-15-6) is a chemical compound with molecular formula C4H7ClN2O3 and molecular weight 166.56 g/mol. Its IUPAC systematic name is methyl N-(2-chloroethyl)-N-nitrosocarbamate. LogP 1.0 Topological Polar Surface Area 59.0 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 4 Rotatable Bonds 3 Exact Mass 166.01453 Heavy Atoms 10 Complexity 130.0 InChI Key: ZIVWROYTZSSKDC-UHFFFAOYSA-N. SMILES: COC(=O)N(CCCl)N=O.

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