Home Nitriles 2,6-Dimethylphenylacetonitrile

2,6-Dimethylphenylacetonitrile

CAS No.:
54708-14-4
Catalog Number:
AG003AXP
Molecular Formula:
C10H11N
Molecular Weight:
145.2010
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$125
- +
5g
98%
In Stock USA
United States
$375
- +
10g
98%
In Stock USA
United States
$694
- +
25g
98%
In Stock USA
United States
$1250
- +
Product Description
Catalog Number:
AG003AXP
Chemical Name:
2,6-Dimethylphenylacetonitrile
CAS Number:
54708-14-4
Molecular Formula:
C10H11N
Molecular Weight:
145.2010
MDL Number:
MFCD00060300
IUPAC Name:
2-(2,6-dimethylphenyl)acetonitrile
InChI:
InChI=1S/C10H11N/c1-8-4-3-5-9(2)10(8)6-7-11/h3-5H,6H2,1-2H3
InChI Key:
ABOLDLVTFQCAHP-UHFFFAOYSA-N
SMILES:
N#CCc1c(C)cccc1C
Properties
Complexity:
155  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
145.089g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
145.205g/mol
Monoisotopic Mass:
145.089g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties