Hexachlorobenzene
Properties
- Molecular formula
- C6Cl6
- Molar mass
- 284.77 g/mol
- Exact mass
- 281.8131 Da
- Density
- 2.044 g/mL (at 23 °C)
- Melting point
- 231.8 °C
- Boiling point
- 325 °C
- Flash point
- 242 °C (closed cup)
- Water solubility
- < 1 g/L (20 °C)
- logP
- 5.61Crippen estimate
- Polar surface area
- 0.0 Ų
- H-bond donors / acceptors
- 0 / 0
- Rotatable bonds
- 0
Hazards
Danger
- H350 May cause cancerCarcinogenicity
- H372 ** Causes damage to organs through prolonged or repeated exposureSpecific target organ toxicity, repeated exposure
- H400 Very toxic to aquatic lifeHazardous to the aquatic environment, acute hazard
- H410 Very toxic to aquatic life with long lasting effectsHazardous to the aquatic environment, long-term hazard
Harmonised EU classification (CLP Annex VI, index 602-065-00-6), via PubChem.
Precautionary statements
P203, P260, P264, P270, P273, P280, P318, P319, P391, P405, P501
Identifiers
CAS number
118-74-1SMILES
Clc1c(Cl)c(Cl)c(Cl)c(Cl)c1ClInChIKey
CKAPSXZOOQJIBF-UHFFFAOYSA-NInChI
InChI=1S/C6Cl6/c7-1-2(8)4(10)6(12)5(11)3(1)9Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
22 names · show all
- Benzene, 1,2,3,4,5,6-hexachloro-
- Benzene, hexachloro-
- 1,2,3,4,5,6-Hexachlorobenzene
- Bunt-cure
- Bunt-no-more
- Anticarie
- HCB
- Julin's carbon chloride
- No bunt
- No bunt 40
- No bunt 80
- No bunt liquid
- Perchlorobenzene
- Sanocide
- Amatin
- Co-op Hexa
- Pentachlorophenyl chloride
- Snieciotox
- Zaprawa nasienna sneciotox
- HCB (pesticide)
- NSC 9243
- BHC
Work with Hexachlorobenzene
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
Octachloronaphthalene2234-13-167 % similar
Tetrachlorocatechol1198-55-650 % similar
Pentachlorobenzenethiol133-49-350 % similar
Bis(2,3,4,5,6-pentachlorophenyl) disulfide22441-21-050 % similar
Pentachloroaniline527-20-850 % similar
Pentachlorophenol87-86-550 % similar
Pentachloropyridine2176-62-746 % similar
Pentachlorobenzene608-93-546 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.