Home Halogens 2-{[(4-chlorophenyl)methyl]amino}acetic acid hydrochloride

2-{[(4-chlorophenyl)methyl]amino}acetic acid hydrochloride

CAS No.:
90562-54-2
Catalog Number:
AG01AILZ
Molecular Formula:
C9H11Cl2NO2
Molecular Weight:
236.0951
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Product Description
Catalog Number:
AG01AILZ
Chemical Name:
2-{[(4-chlorophenyl)methyl]amino}acetic acid hydrochloride
CAS Number:
90562-54-2
Molecular Formula:
C9H11Cl2NO2
Molecular Weight:
236.0951
MDL Number:
MFCD17430341
IUPAC Name:
2-[(4-chlorophenyl)methylamino]acetic acid;hydrochloride
InChI:
InChI=1S/C9H10ClNO2.ClH/c10-8-3-1-7(2-4-8)5-11-6-9(12)13;/h1-4,11H,5-6H2,(H,12,13);1H
InChI Key:
IHCCFLKCGJPXDF-UHFFFAOYSA-N
SMILES:
OC(=O)CNCc1ccc(cc1)Cl.Cl
Properties
Complexity:
167  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.017g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
236.092g/mol
Monoisotopic Mass:
235.017g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties