Home Nitriles Alpha-acetoxyphenylacetonitrile

Alpha-acetoxyphenylacetonitrile

CAS No.:
5762-35-6
Catalog Number:
AG003NRS
Molecular Formula:
C10H9NO2
Molecular Weight:
175.1840
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$119
- +
5g
97%
In Stock USA
United States
$369
- +
Product Description
Catalog Number:
AG003NRS
Chemical Name:
Alpha-acetoxyphenylacetonitrile
CAS Number:
5762-35-6
Molecular Formula:
C10H9NO2
Molecular Weight:
175.1840
MDL Number:
MFCD22205885
IUPAC Name:
[cyano(phenyl)methyl] acetate
InChI:
InChI=1S/C10H9NO2/c1-8(12)13-10(7-11)9-5-3-2-4-6-9/h2-6,10H,1H3
InChI Key:
MUXDFYRMYMEGCM-UHFFFAOYSA-N
SMILES:
N#CC(c1ccccc1)OC(=O)C
NSC Number:
75733
Properties
Complexity:
222  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.063g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
175.187g/mol
Monoisotopic Mass:
175.063g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
50.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties