Basic information
- CAS
26523-63-7- Standard SMILES
ClC(Cl)(Cl)CCC(Cl)(Cl)Cl- InChIKey
MINPZZUPSSVGJN-UHFFFAOYSA-N- Molecular formula
- C4H4Cl6
- Average molar mass
- 264.8 g/mol
- Monoisotopic mass
- 261.844416
Names & identifiers
- Preferred name
- Butane, hexachloro-
- IUPAC
- 1,1,1,4,4,4-hexachlorobutane
Names & synonyms
HexachlorobutaneBUTANE, HEXACHLORO-26523-63-7RefChem:5707621,1,1,4,4,4-HEXACHLOROBUTANEPCB2SCHEMBL2455472DTXSID209493811,1,1,4,4,4-hexa-chlorobutane79458-54-1
Database identifiers
- CAS
26523-63-7、79458-54-1- PubChem CID
- 33526
- DTXSID
DTXSID20949381- Nikkaji
- J1.591.458K
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 83.3
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationChemical: Butane, hexachloro-
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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