Home Other Building Blocks 3-cyano-N-(furan-2-ylmethyl)benzamide

3-cyano-N-(furan-2-ylmethyl)benzamide

CAS No.:
879183-68-3
Catalog Number:
AG019MV2
Molecular Formula:
C13H10N2O2
Molecular Weight:
226.2307
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Product Description
Catalog Number:
AG019MV2
Chemical Name:
3-cyano-N-(furan-2-ylmethyl)benzamide
CAS Number:
879183-68-3
Molecular Formula:
C13H10N2O2
Molecular Weight:
226.2307
MDL Number:
MFCD08495254
IUPAC Name:
3-cyano-N-(furan-2-ylmethyl)benzamide
InChI:
InChI=1S/C13H10N2O2/c14-8-10-3-1-4-11(7-10)13(16)15-9-12-5-2-6-17-12/h1-7H,9H2,(H,15,16)
InChI Key:
GUSNUBZVXMNRLD-UHFFFAOYSA-N
SMILES:
N#Cc1cccc(c1)C(=O)NCc1ccco1
Properties
Complexity:
321  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.074g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
226.235g/mol
Monoisotopic Mass:
226.074g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties