Home Aminos 4-amino-2-benzylbutanoic acid hydrochloride

4-amino-2-benzylbutanoic acid hydrochloride

CAS No.:
1387445-55-7
Catalog Number:
AG01AG7H
Molecular Formula:
C11H16ClNO2
Molecular Weight:
229.7032
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Product Description
Catalog Number:
AG01AG7H
Chemical Name:
4-amino-2-benzylbutanoic acid hydrochloride
CAS Number:
1387445-55-7
Molecular Formula:
C11H16ClNO2
Molecular Weight:
229.7032
MDL Number:
MFCD22382014
IUPAC Name:
4-amino-2-benzylbutanoic acid;hydrochloride
InChI:
InChI=1S/C11H15NO2.ClH/c12-7-6-10(11(13)14)8-9-4-2-1-3-5-9;/h1-5,10H,6-8,12H2,(H,13,14);1H
InChI Key:
ZGEWLPFCFRTFTD-UHFFFAOYSA-N
SMILES:
NCCC(C(=O)O)Cc1ccccc1.Cl
Properties
Complexity:
176  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.087g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
229.704g/mol
Monoisotopic Mass:
229.087g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties