Compound C13H19Cl3N2O3

bis(2-chloroethyl)-[(4-ethoxy-3-nitrophenyl)methyl]azanium chloride

CAS: 77905-52-3

Molecular Formula	`C13H19Cl3N2O3`
Molecular Weight	357.7 g/mol
Topological Polar Surface Area	59.5 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	8
Exact Mass	356.0461
Heavy Atoms	21
Complexity	283.0

Chemical Identifiers

CAS Number	77905-52-3
SMILES	`CCOC1=C(C=C(C=C1)C[NH+](CCCl)CCCl)[N+](=O)[O-].[Cl-]`
InChIKey	`CWAWACLVCCFRFP-UHFFFAOYSA-N`

📖 Product Overview

Compound C13H19Cl3N2O3 (CAS: 77905-52-3) is a chemical compound with molecular formula C13H19Cl3N2O3 and molecular weight 357.7 g/mol. Its IUPAC systematic name is bis(2-chloroethyl)-[(4-ethoxy-3-nitrophenyl)methyl]azanium chloride. Topological Polar Surface Area 59.5 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 8 Exact Mass 356.0461 Heavy Atoms 21 Complexity 283.0 InChI Key: CWAWACLVCCFRFP-UHFFFAOYSA-N. SMILES: CCOC1=C(C=C(C=C1)C[NH+](CCCl)CCCl)[N+](=O)[O-].[Cl-].

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