Compound C13H17Cl2NO2

3-[3-[bis(2-chloroethyl)amino]phenyl]propanoic acid

CAS: 4252-25-9

Molecular Formula	`C13H17Cl2NO2`
Molecular Weight	290.18 g/mol
LogP	3.0
Topological Polar Surface Area	40.5 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	8
Exact Mass	289.06363
Heavy Atoms	18
Complexity	245.0

Chemical Identifiers

CAS Number	4252-25-9
SMILES	`C1=CC(=CC(=C1)N(CCCl)CCCl)CCC(=O)O`
InChIKey	`DZZLSUVOCHEQJL-UHFFFAOYSA-N`

📖 Product Overview

Compound C13H17Cl2NO2 (CAS: 4252-25-9) is a chemical compound with molecular formula C13H17Cl2NO2 and molecular weight 290.18 g/mol. Its IUPAC systematic name is 3-[3-[bis(2-chloroethyl)amino]phenyl]propanoic acid. LogP 3.0 Topological Polar Surface Area 40.5 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 8 Exact Mass 289.06363 Heavy Atoms 18 Complexity 245.0 InChI Key: DZZLSUVOCHEQJL-UHFFFAOYSA-N. SMILES: C1=CC(=CC(=C1)N(CCCl)CCCl)CCC(=O)O.

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