2,3,4,5-Tetrachlorothiophene

C4Cl4SCAS 6012-97-1221.90 g/mol

Open in Covalent MOL file
ClSClClCl
Aryl halide

Properties

Molecular formula
C4Cl4S
Molar mass
221.90 g/mol
Exact mass
219.8475 Da
Melting point
30.5 °C
Boiling point
233.4 °C
logP
4.36Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
0

Hazards

Danger
Acute Toxic (GHS06)

Aggregated from 44 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P262, P264, P270, P271, P280, P301+P316, P302+P352, P304+P340, P316, P321, P330, P361+P364, P403+P233, P405, P501

Identifiers

CAS number
6012-97-1
SMILES
Clc1sc(Cl)c(Cl)c1Cl
InChIKey
WZXXZHONLFRKGG-UHFFFAOYSA-N
InChI
InChI=1S/C4Cl4S/c5-1-2(6)4(8)9-3(1)7

Weigh it out

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

Names and synonyms

8 names
  • Thiophene, 2,3,4,5-tetrachloro-
  • Thiophene, tetrachloro-
  • Tetrachlorothiophene
  • Penphene
  • Perchlorothiophene
  • IF
  • NSC 44615
  • NSC 61442

Work with 2,3,4,5-Tetrachlorothiophene

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

Hexachlorobenzene118-74-138 % similar 4,5-Dichloro-1,2-dithiol-3-one1192-52-536 % similar 2,5-Dichloro-3,4-dinitrothiophene51584-21-533 % similar Octachloronaphthalene2234-13-131 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook