Cyclohexyl carbonochloridate

C7H11ClO2CAS 13248-54-9162.61 g/mol

OClO
Acyl halide

Properties

Molecular formula
C7H11ClO2
Molar mass
162.61 g/mol
Exact mass
162.0448 Da
Boiling point
78–83 °C (at 12 Torr)
logP
2.69Crippen estimate
Polar surface area
26.3 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
1

Hazards

Danger
Corrosive (GHS05)Acute Toxic (GHS06)Irritant (GHS07)Health Hazard (GHS08)Environmental Hazard (GHS09)

Aggregated from 3 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P261, P262, P264, P264+P265, P270, P271, P272, P273, P280, P301+P316, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P319, P321, P330, P333+P317, P361+P364, P362+P364, P363, P391, P403+P233, P405, P501

Identifiers

CAS number
13248-54-9
SMILES
O=C(Cl)OC1CCCCC1
InChIKey
IWVJLGPDBXCTDA-UHFFFAOYSA-N
InChI
InChI=1S/C7H11ClO2/c8-7(9)10-6-4-2-1-3-5-6/h6H,1-5H2

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Names and synonyms

5 names
  • Carbonochloridic acid, cyclohexyl ester
  • Formic acid, chloro-, cyclohexyl ester
  • Chloroformic acid cyclohexyl ester
  • Cyclohexyl chloroformate
  • (Cyclohexyloxy)carbonyl chloride

Work with Cyclohexyl carbonochloridate

Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue.

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