Cyclohexane | SBID = 390 | Compound | Pubchem logo

Struc Structure

Molecular Properties

Interactions: 4
PubChem TPSA/Å2: 0.0
Ertl TPSA/Å2:
Hydrophilicity (PubChem XLogP): 3.4
Hydrophilicity (Cheng XLogP3):
Charge: 0.0
Number of H-Bond Donors: 0.0
Number of H-Bond Acceptors: 0.0
Number of Stereogenic Bonds (E/Z): 0.0
Number of Stereogenic Atoms (R/S): 0.0
3D Volume/Å3: 75.9
Sum Formula: C6H12
M / g/mol: 84.162
Complexity: 15.0
Number of Conformers: 1.0

Identifiers

  • Tags: aliphatic, typical guest
  • Name: Cyclohexane
  • Preferred Abbreviation: Cyclohexane
  • IUPAC Name: cyclohexane
  • CAS: 110-82-7
  • CID: 8078
  • InChiKey: XDTMQSROBMDMFD-UHFFFAOYSA-N
  • InChi: InChI=1S/C6H12/c1-2-4-6-5-3-1/h1-6H2
  • CanoSmiles: C1CCCCC1
  • IsoSmiles: C1CCCCC1