Home Halogens ethyl 3-[(2-chlorophenyl)amino]-2-cyanoprop-2-enoate

ethyl 3-[(2-chlorophenyl)amino]-2-cyanoprop-2-enoate

CAS No.:
7510-65-8
Catalog Number:
AG019NIK
Molecular Formula:
C12H11ClN2O2
Molecular Weight:
250.6809
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Product Description
Catalog Number:
AG019NIK
Chemical Name:
ethyl 3-[(2-chlorophenyl)amino]-2-cyanoprop-2-enoate
CAS Number:
7510-65-8
Molecular Formula:
C12H11ClN2O2
Molecular Weight:
250.6809
MDL Number:
MFCD00695447
IUPAC Name:
ethyl (Z)-3-(2-chloroanilino)-2-cyanoprop-2-enoate
InChI:
InChI=1S/C12H11ClN2O2/c1-2-17-12(16)9(7-14)8-15-11-6-4-3-5-10(11)13/h3-6,8,15H,2H2,1H3/b9-8-
InChI Key:
SWCQAAUPCCUXBT-HJWRWDBZSA-N
SMILES:
CCOC(=O)C(=CNc1ccccc1Cl)C#N
NSC Number:
405746
Properties
Complexity:
346  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
250.051g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
250.682g/mol
Monoisotopic Mass:
250.051g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
62.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties