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Home Nitriles 2,2-dimethylcyclopropanecarbonitrile

2,2-dimethylcyclopropanecarbonitrile

CAS No.:
5722-11-2
Catalog Number:
AG003B3B
Molecular Formula:
C6H9N
Molecular Weight:
95.1424
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$50
- +
5g
98%
In Stock USA
United States
$165
- +
25g
98%
In Stock USA
United States
$494
- +
Product Description
Catalog Number:
AG003B3B
Chemical Name:
2,2-dimethylcyclopropanecarbonitrile
CAS Number:
5722-11-2
Molecular Formula:
C6H9N
Molecular Weight:
95.1424
MDL Number:
MFCD01321153
IUPAC Name:
2,2-dimethylcyclopropane-1-carbonitrile
InChI:
InChI=1S/C6H9N/c1-6(2)3-5(6)4-7/h5H,3H2,1-2H3
InChI Key:
CZPCJHBAFHCDRE-UHFFFAOYSA-N
SMILES:
N#CC1CC1(C)C
NSC Number:
92356
Properties
Complexity:
126  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
95.073g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
95.145g/mol
Monoisotopic Mass:
95.073g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Literature
Title Journal
Screening, cultivation, and biocatalytic performance of Rhodococcus boritolerans FW815 with strong 2,2-dimethylcyclopropanecarbonitrile hydratase activity. Journal of industrial microbiology & biotechnology 20120301
Properties