Home Aminos ethyl 2-amino-3-(4-cyanophenyl)propanoate hydrochloride

ethyl 2-amino-3-(4-cyanophenyl)propanoate hydrochloride

CAS No.:
193634-20-7
Catalog Number:
AG01DW4H
Molecular Formula:
C12H15ClN2O2
Molecular Weight:
254.7127
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Product Description
Catalog Number:
AG01DW4H
Chemical Name:
ethyl 2-amino-3-(4-cyanophenyl)propanoate hydrochloride
CAS Number:
193634-20-7
Molecular Formula:
C12H15ClN2O2
Molecular Weight:
254.7127
MDL Number:
MFCD22691142
IUPAC Name:
ethyl 2-amino-3-(4-cyanophenyl)propanoate;hydrochloride
InChI:
InChI=1S/C12H14N2O2.ClH/c1-2-16-12(15)11(14)7-9-3-5-10(8-13)6-4-9;/h3-6,11H,2,7,14H2,1H3;1H
InChI Key:
WLBXUIZRDLTCQZ-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(Cc1ccc(cc1)C#N)N.Cl
Properties
Complexity:
274  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.082g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
254.714g/mol
Monoisotopic Mass:
254.082g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
76.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties