chempirical

(Chlorocarbonyl)sulfenyl chloride

CCl2OSCAS 2757-23-5130.97 g/mol

Open in Covalent MOL file
OClSCl
Acyl halide

Properties

Molecular formula
CCl2OS
Molar mass
130.97 g/mol
Exact mass
129.9047 Da
Density
1.569 g/mL (at 22 °C)
Boiling point
98 °C
logP
2.23Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
0

Hazards

Danger
Corrosive (GHS05)

Aggregated from 49 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, P501

Identifiers

CAS number
2757-23-5
SMILES
O=C(Cl)SCl
InChIKey
MNOALXGAYUJNKX-UHFFFAOYSA-N
InChI
InChI=1S/CCl2OS/c2-1(4)5-3

Weigh it out

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

Names and synonyms

11 names
  • Carbonochloridothioic acid, anhydrosulfide with thiohypochlorous acid
  • Formyl thiohypochlorite, chloro-
  • Formyl chloride, (chlorothio)-
  • Sulfenyl chloride, (chloroformyl)-
  • (Chlorothio)formyl chloride
  • (Chloroformyl)sulfur chloride
  • Chloroformylsulfenyl chloride
  • 1-(Chlorothio)formyl chloride
  • Chlorosulfenylcarbonyl chloride
  • Carbonochloridic hypochlorous thioanhydride
  • Chlorocarboynylsulfenyl chloride

Work with (Chlorocarbonyl)sulfenyl chloride

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Ethyl chlorothioformate2941-64-236 % similar Methyl (chlorosulfenyl)formate26555-40-835 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook