Home Other Building Blocks N-(cyanomethyl)-4-fluoro-3-methylbenzamide

N-(cyanomethyl)-4-fluoro-3-methylbenzamide

CAS No.:
1342116-15-7
Catalog Number:
AG01B246
Molecular Formula:
C10H9FN2O
Molecular Weight:
192.1897
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Product Description
Catalog Number:
AG01B246
Chemical Name:
N-(cyanomethyl)-4-fluoro-3-methylbenzamide
CAS Number:
1342116-15-7
Molecular Formula:
C10H9FN2O
Molecular Weight:
192.1897
MDL Number:
MFCD18293746
IUPAC Name:
N-(cyanomethyl)-4-fluoro-3-methylbenzamide
InChI:
InChI=1S/C10H9FN2O/c1-7-6-8(2-3-9(7)11)10(14)13-5-4-12/h2-3,6H,5H2,1H3,(H,13,14)
InChI Key:
XVUPVFMYJWKTQQ-UHFFFAOYSA-N
SMILES:
N#CCNC(=O)c1ccc(c(c1)C)F
Properties
Complexity:
258  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.07g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
192.193g/mol
Monoisotopic Mass:
192.07g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties