Home Aminos propan-2-yl 3-amino-3-(4-methylphenyl)propanoate hydrochloride

propan-2-yl 3-amino-3-(4-methylphenyl)propanoate hydrochloride

CAS No.:
1049772-89-5
Catalog Number:
AG019PD5
Molecular Formula:
C13H20ClNO2
Molecular Weight:
257.7564
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Product Description
Catalog Number:
AG019PD5
Chemical Name:
propan-2-yl 3-amino-3-(4-methylphenyl)propanoate hydrochloride
CAS Number:
1049772-89-5
Molecular Formula:
C13H20ClNO2
Molecular Weight:
257.7564
MDL Number:
MFCD07838458
IUPAC Name:
propan-2-yl 3-amino-3-(4-methylphenyl)propanoate;hydrochloride
InChI:
InChI=1S/C13H19NO2.ClH/c1-9(2)16-13(15)8-12(14)11-6-4-10(3)5-7-11;/h4-7,9,12H,8,14H2,1-3H3;1H
InChI Key:
ZTLVIFOMOICNSQ-UHFFFAOYSA-N
SMILES:
CC(OC(=O)CC(c1ccc(cc1)C)N)C.Cl
Properties
Complexity:
220  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.118g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
257.758g/mol
Monoisotopic Mass:
257.118g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties