[C-]#[N+]C1CCCCC1
CAS: 931-53-3
Name: isocyanocyclohexane
SMILES: [C-]#[N+]C1CCCCC1

Molecular Processing

Molecular formula
C7H11N
Molecular weight
109.17
Exact mass
109.0891
XLogP
2.24
TPSA
4.36
H-bond donors
0
H-bond acceptors
0
Rotatable bonds
0
Heavy atoms
8
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.857
Molar refractivity
33.47

Supplementary Information

InChIKey: XYZMOVWWVXBHDP-UHFFFAOYSA-N
Synonyms
Cyclohexyl isocyanide931-53-3IsocyanocyclohexaneCyclohexane, isocyano-CyclohexaneisonitrileN-CyclohexylisocyanideNSC-60128N7L87QP9YGCHEBI:17966DTXSID90239266RefChem:580810DTXCID10161757213-238-7CyclohexylisocyanideMFCD00003839Cyclohexyl isonitrileCYIcyclohexylisonitrileIsocyano-cyclohexaneEINECS 213-238-73-Isocyano-cyclohexaneCYCLOHEXYL-ISOCYANIDESCHEMBL243870SCHEMBL1988993NSC60128GEO-00871NSC 60128AKOS001476742CS-W004145LS-13296
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