Home Aminos ethyl 2-cyano-3-[(2-fluorophenyl)amino]prop-2-enoate

ethyl 2-cyano-3-[(2-fluorophenyl)amino]prop-2-enoate

CAS No.:
934070-55-0
Catalog Number:
AG019VWS
Molecular Formula:
C12H11FN2O2
Molecular Weight:
234.2263
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Product Description
Catalog Number:
AG019VWS
Chemical Name:
ethyl 2-cyano-3-[(2-fluorophenyl)amino]prop-2-enoate
CAS Number:
934070-55-0
Molecular Formula:
C12H11FN2O2
Molecular Weight:
234.2263
MDL Number:
MFCD00855212
IUPAC Name:
ethyl 2-cyano-3-(2-fluoroanilino)prop-2-enoate
InChI:
InChI=1S/C12H11FN2O2/c1-2-17-12(16)9(7-14)8-15-11-6-4-3-5-10(11)13/h3-6,8,15H,2H2,1H3
InChI Key:
GUXJSHDCEAORRS-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(=CNc1ccccc1F)C#N
Properties
Complexity:
346  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.08g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
234.23g/mol
Monoisotopic Mass:
234.08g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
62.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
2.8  
Properties