Home Halogens ethyl 3-amino-3-(3-chlorophenyl)propanoate

ethyl 3-amino-3-(3-chlorophenyl)propanoate

CAS No.:
498581-88-7
Catalog Number:
AG01DSXH
Molecular Formula:
C11H14ClNO2
Molecular Weight:
227.6874
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Product Description
Catalog Number:
AG01DSXH
Chemical Name:
ethyl 3-amino-3-(3-chlorophenyl)propanoate
CAS Number:
498581-88-7
Molecular Formula:
C11H14ClNO2
Molecular Weight:
227.6874
MDL Number:
MFCD03839220
IUPAC Name:
ethyl 3-amino-3-(3-chlorophenyl)propanoate
InChI:
InChI=1S/C11H14ClNO2/c1-2-15-11(14)7-10(13)8-4-3-5-9(12)6-8/h3-6,10H,2,7,13H2,1H3
InChI Key:
PQQICJYHWOLBIR-UHFFFAOYSA-N
SMILES:
CCOC(=O)CC(c1cccc(c1)Cl)N
Properties
Complexity:
211  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.071g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
227.688g/mol
Monoisotopic Mass:
227.071g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties