Home Other Building Blocks N-(1-Cyano-1-methylethyl)benzamide

N-(1-Cyano-1-methylethyl)benzamide

CAS No.:
54016-31-8
Catalog Number:
AG01AIN5
Molecular Formula:
C11H12N2O
Molecular Weight:
188.2258
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
98%
1 week
United States
$142
- +
1g
98%
1 week
United States
$448
- +
Product Description
Catalog Number:
AG01AIN5
Chemical Name:
N-(1-Cyano-1-methylethyl)benzamide
CAS Number:
54016-31-8
Molecular Formula:
C11H12N2O
Molecular Weight:
188.2258
MDL Number:
MFCD00835185
IUPAC Name:
N-(2-cyanopropan-2-yl)benzamide
InChI:
InChI=1S/C11H12N2O/c1-11(2,8-12)13-10(14)9-6-4-3-5-7-9/h3-7H,1-2H3,(H,13,14)
InChI Key:
KQMOBXIDUMSODX-UHFFFAOYSA-N
SMILES:
N#CC(NC(=O)c1ccccc1)(C)C
Properties
Complexity:
256  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.095g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
188.23g/mol
Monoisotopic Mass:
188.095g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties