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

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

CAS No.:
1172479-10-5
Catalog Number:
AG019UYC
Molecular Formula:
C10H13Cl2NO2
Molecular Weight:
250.1217
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Product Description
Catalog Number:
AG019UYC
Chemical Name:
3-{[(4-chlorophenyl)methyl]amino}propanoic acid hydrochloride
CAS Number:
1172479-10-5
Molecular Formula:
C10H13Cl2NO2
Molecular Weight:
250.1217
MDL Number:
MFCD11858031
IUPAC Name:
3-[(4-chlorophenyl)methylamino]propanoic acid;hydrochloride
InChI:
InChI=1S/C10H12ClNO2.ClH/c11-9-3-1-8(2-4-9)7-12-6-5-10(13)14;/h1-4,12H,5-7H2,(H,13,14);1H
InChI Key:
HLAILPIZHMVJGM-UHFFFAOYSA-N
SMILES:
OC(=O)CCNCc1ccc(cc1)Cl.Cl
Properties
Complexity:
179  
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:
5  
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties