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Home Nitriles Cyclohexanecarbonitrile

Cyclohexanecarbonitrile

CAS No.:
766-05-2
Catalog Number:
AG0034NG
Molecular Formula:
C7H11N
Molecular Weight:
109.1689
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$13
- +
5g
97%
In Stock USA
United States
$32
- +
25g
97%
In Stock USA
United States
$75
- +
100g
97%
In Stock USA
United States
$225
- +
Product Description
Catalog Number:
AG0034NG
Chemical Name:
Cyclohexanecarbonitrile
CAS Number:
766-05-2
Molecular Formula:
C7H11N
Molecular Weight:
109.1689
MDL Number:
MFCD00040444
IUPAC Name:
cyclohexanecarbonitrile
InChI:
InChI=1S/C7H11N/c8-6-7-4-2-1-3-5-7/h7H,1-5H2
InChI Key:
VBWIZSYFQSOUFQ-UHFFFAOYSA-N
SMILES:
N#CC1CCCCC1
EC Number:
212-157-4
NSC Number:
17557
Properties
Complexity:
103  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
109.089g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
109.172g/mol
Monoisotopic Mass:
109.089g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Literature
Title Journal
N-(4-cyanotetrahydro-2H-pyran-4-yl) and N-(1-cyanocyclohexyl) derivatives of 1,5-diarylpyrazole-3-carboxamides showing high affinity for 18 kDa translocator protein and/or cannabinoid receptors. Journal of medicinal chemistry 20110428
Homogeneous dehydrogenation of liquid organic hydrogen carriers catalyzed by an iridium PCP complex. Faraday discussions 20110101
Study of supercooled orientationally disordered binary solid solutions II: cyclohexyl derivatives, neopentanol and neopentylglycol. Physical chemistry chemical physics : PCCP 20091028
Study of secondary relaxation in disordered plastic crystals of isocyanocyclohexane, cyanocyclohexane, and 1-cyanoadamantane. The Journal of chemical physics 20080907
Cis-bis(acetonitrile)tetrachlorotin(IV) acetonitrile solvate, cis-tetrachlorobis(propiononitrile)tin(IV) propiononitrile solvate, cis-tetrachlorobis(isobutyronitrile)tin(IV), cis-tetrachlorobis(cyclohexanecarbonitrile)tin(IV) and cis-tetrachlorobis(o-toluonitrile)tin(IV), all determined at ca 150 K. Acta crystallographica. Section C, Crystal structure communications 20030901
Properties