Home Other Building Blocks ALPHA-ACETYLPHENYLACETONITRILE

ALPHA-ACETYLPHENYLACETONITRILE

CAS No.:
120065-76-1
Catalog Number:
AG008RXD
Molecular Formula:
Molecular Weight:
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
> 99% (HPLC)
1 week
United States
$83
- +
5g
> 99% (HPLC)
1 week
United States
$190
- +
25g
> 99% (HPLC)
1 week
United States
$674
- +
Product Description
Catalog Number:
AG008RXD
Chemical Name:
ALPHA-ACETYLPHENYLACETONITRILE
CAS Number:
120065-76-1
MDL Number:
MFCD00001867
IUPAC Name:
3-oxo-2-phenylbutanenitrile
InChI:
InChI=1S/C10H9NO/c1-8(12)10(7-11)9-5-3-2-4-6-9/h2-6,10H,1H3
InChI Key:
KHNWFTMUBKJWRZ-UHFFFAOYSA-N
EC Number:
224-737-4
Properties
Complexity:
207  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.068g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
159.188g/mol
Monoisotopic Mass:
159.068g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
40.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties