Compound C14H21Cl3N2O3

bis(2-chloroethyl)-[(3-nitro-4-propoxyphenyl)methyl]azanium chloride

CAS: 77905-53-4

Molecular Formula	`C14H21Cl3N2O3`
Molecular Weight	371.7 g/mol
Topological Polar Surface Area	59.5 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	9
Exact Mass	370.06177
Heavy Atoms	22
Complexity	296.0

Chemical Identifiers

CAS Number	77905-53-4
SMILES	`CCCOC1=C(C=C(C=C1)C[NH+](CCCl)CCCl)[N+](=O)[O-].[Cl-]`
InChIKey	`JPRJPOPXYBVDDK-UHFFFAOYSA-N`

📖 Product Overview

Compound C14H21Cl3N2O3 (CAS: 77905-53-4) is a chemical compound with molecular formula C14H21Cl3N2O3 and molecular weight 371.7 g/mol. Its IUPAC systematic name is bis(2-chloroethyl)-[(3-nitro-4-propoxyphenyl)methyl]azanium chloride. Topological Polar Surface Area 59.5 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 9 Exact Mass 370.06177 Heavy Atoms 22 Complexity 296.0 InChI Key: JPRJPOPXYBVDDK-UHFFFAOYSA-N. SMILES: CCCOC1=C(C=C(C=C1)C[NH+](CCCl)CCCl)[N+](=O)[O-].[Cl-].

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