Home Aminos benzyl 3-aminobutanoate hydrochloride

benzyl 3-aminobutanoate hydrochloride

CAS No.:
1423029-31-5
Catalog Number:
AG01A2DA
Molecular Formula:
C11H16ClNO2
Molecular Weight:
229.7032
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Product Description
Catalog Number:
AG01A2DA
Chemical Name:
benzyl 3-aminobutanoate hydrochloride
CAS Number:
1423029-31-5
Molecular Formula:
C11H16ClNO2
Molecular Weight:
229.7032
MDL Number:
MFCD22578530
IUPAC Name:
benzyl 3-aminobutanoate;hydrochloride
InChI:
InChI=1S/C11H15NO2.ClH/c1-9(12)7-11(13)14-8-10-5-3-2-4-6-10;/h2-6,9H,7-8,12H2,1H3;1H
InChI Key:
FFGHYYGPFHLTRD-UHFFFAOYSA-N
SMILES:
CC(CC(=O)OCc1ccccc1)N.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:
2  
Isotope Atom Count:
0
Molecular Weight:
229.704g/mol
Monoisotopic Mass:
229.087g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties