Cyclohexanethiol

C6H12SCAS 1569-69-3116.22 g/mol

HS
Thiol

Properties

Molecular formula
C6H12S
Molar mass
116.22 g/mol
Exact mass
116.0660 Da
Density
0.9782 g/mL (at 20 °C)
Melting point
−118 °C
Boiling point
158.9 °C
Flash point
43 °C (closed cup)
Water solubility
insoluble
logP
2.25Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Hazards

Warning
Flammable (GHS02)Irritant (GHS07)Environmental Hazard (GHS09)

Aggregated from 48 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P391, P403+P233, P403+P235, P405, P501

Identifiers

CAS number
1569-69-3
SMILES
SC1CCCCC1
InChIKey
CMKBCTPCXZNQKX-UHFFFAOYSA-N
InChI
InChI=1S/C6H12S/c7-6-4-2-1-3-5-6/h6-7H,1-5H2

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Type any one amount. The others follow from the molar mass and density.

Names and synonyms

4 names
  • Cyclohexyl mercaptan
  • Cyclohexylthiol
  • Mercaptocyclohexane
  • NSC 59723

Work with Cyclohexanethiol

Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue.

Same formula

Elsewhere