Home Halogens 3-amino-2-[(4-chlorophenyl)methyl]propanoic acid hydrochloride

3-amino-2-[(4-chlorophenyl)methyl]propanoic acid hydrochloride

CAS No.:
1305712-03-1
Catalog Number:
AG01ABEM
Molecular Formula:
C10H13Cl2NO2
Molecular Weight:
250.1217
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Product Description
Catalog Number:
AG01ABEM
Chemical Name:
3-amino-2-[(4-chlorophenyl)methyl]propanoic acid hydrochloride
CAS Number:
1305712-03-1
Molecular Formula:
C10H13Cl2NO2
Molecular Weight:
250.1217
MDL Number:
MFCD06227805
IUPAC Name:
2-(aminomethyl)-3-(4-chlorophenyl)propanoic acid;hydrochloride
InChI:
InChI=1S/C10H12ClNO2.ClH/c11-9-3-1-7(2-4-9)5-8(6-12)10(13)14;/h1-4,8H,5-6,12H2,(H,13,14);1H
InChI Key:
QCQYRFIMBXDNKI-UHFFFAOYSA-N
SMILES:
NCC(C(=O)O)Cc1ccc(cc1)Cl.Cl
Properties
Complexity:
191  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.032g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
250.119g/mol
Monoisotopic Mass:
249.032g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties