ethyl (Z)-3-[(4-chlorophenyl)amino]-2-cyano-prop-2-enoate


Chemical Name: ethyl (Z)-3-[(4-chlorophenyl)amino]-2-cyano-prop-2-enoate
CAS Number: 19141-18-5
Product Number: AG00IRE8(AGN-PC-0O65SF)
Synonyms:
MDL No: MFCD00665122
Molecular Formula: C12H11ClN2O2
Molecular Weight: 250.6809

Identification/Properties


Computed Properties
Molecular Weight:
250.682g/mol
XLogP3:
3.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
5
Exact Mass:
250.051g/mol
Monoisotopic Mass:
250.051g/mol
Topological Polar Surface Area:
62.1A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
338
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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