Home Aminos methyl 3-amino-2-[(3-methylphenyl)methyl]propanoate hydrochloride

methyl 3-amino-2-[(3-methylphenyl)methyl]propanoate hydrochloride

CAS No.:
1258650-26-8
Catalog Number:
AG01AB7A
Molecular Formula:
C12H18ClNO2
Molecular Weight:
243.7298
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Product Description
Catalog Number:
AG01AB7A
Chemical Name:
methyl 3-amino-2-[(3-methylphenyl)methyl]propanoate hydrochloride
CAS Number:
1258650-26-8
Molecular Formula:
C12H18ClNO2
Molecular Weight:
243.7298
MDL Number:
MFCD17977101
IUPAC Name:
methyl 2-(aminomethyl)-3-(3-methylphenyl)propanoate;hydrochloride
InChI:
InChI=1S/C12H17NO2.ClH/c1-9-4-3-5-10(6-9)7-11(8-13)12(14)15-2;/h3-6,11H,7-8,13H2,1-2H3;1H
InChI Key:
FPDMCIQWYCNVCG-UHFFFAOYSA-N
SMILES:
NCC(C(=O)OC)Cc1cccc(c1)C.Cl
Properties
Complexity:
206  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.103g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
243.731g/mol
Monoisotopic Mass:
243.103g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties