Hexachloropropene
Properties
- Molecular formula
- C3Cl6
- Molar mass
- 248.73 g/mol
- Exact mass
- 245.8131 Da
- Density
- 1.7632 g/mL (at 20 °C)
- Melting point
- −72.9 °C
- Boiling point
- 209.5 °C
- logP
- 4.24Crippen estimate
- Polar surface area
- 0.0 Ų
- H-bond donors / acceptors
- 0 / 0
- Rotatable bonds
- 0
Hazards
Danger
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H330 Fatal if inhaled19.1% of notifiers
- H332 Harmful if inhaled80.9% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from 47 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P260, P261, P264, P264+P265, P271, P280, P284, P302+P352, P304+P340, P305+P351+P338, P316, P317, P319, P320, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
1888-71-7SMILES
ClC(Cl)=C(Cl)C(Cl)(Cl)ClInChIKey
VFDYKPARTDCDCU-UHFFFAOYSA-NInChI
InChI=1S/C3Cl6/c4-1(2(5)6)3(7,8)9Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
9 names
- 1-Propene, 1,1,2,3,3,3-hexachloro-
- Propene, hexachloro-
- 1,1,2,3,3,3-Hexachloro-1-propene
- Hexachloropropylene
- Perchloropropylene
- Perchloropropene
- 1,1,1,2,3,3-Hexachloropropene
- Hexachloro-1-propene
- NSC 7297
Work with Hexachloropropene
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
1,1,2-Trichloro-3,3,3-trifluoro-1-propene431-52-745 % similar
Tetrachloroethylene127-18-433 % similar
Trichloroacetyl chloride76-02-833 % similar
Hexachlorocyclopentadiene77-47-433 % similar
Hexachloroacetone116-16-530 % similar
2,3-Dichloro-1,1,1,4,4,4-hexafluoro-2-butene303-04-830 % similar
1,2-Dichlorotetrafluorocyclobutene-1377-93-530 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.