Home Halogens ethyl 2-amino-3-(4-chloro-3-fluorophenyl)-3-hydroxypropanoate

ethyl 2-amino-3-(4-chloro-3-fluorophenyl)-3-hydroxypropanoate

CAS No.:
1498207-35-4
Catalog Number:
AG01ACKI
Molecular Formula:
C11H13ClFNO3
Molecular Weight:
261.6772
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Product Description
Catalog Number:
AG01ACKI
Chemical Name:
ethyl 2-amino-3-(4-chloro-3-fluorophenyl)-3-hydroxypropanoate
CAS Number:
1498207-35-4
Molecular Formula:
C11H13ClFNO3
Molecular Weight:
261.6772
MDL Number:
MFCD22297102
IUPAC Name:
ethyl 2-amino-3-(4-chloro-3-fluorophenyl)-3-hydroxypropanoate
InChI:
InChI=1S/C11H13ClFNO3/c1-2-17-11(16)9(14)10(15)6-3-4-7(12)8(13)5-6/h3-5,9-10,15H,2,14H2,1H3
InChI Key:
YKXIZWFYORNKLW-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(C(c1ccc(c(c1)F)Cl)O)N
Properties
Complexity:
267  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.057g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
261.677g/mol
Monoisotopic Mass:
261.057g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties