1,1,3,3-Tetrachlorobutane
Basic information
- CAS
39185-82-5- Standard SMILES
CC(Cl)(Cl)CC(Cl)Cl- InChIKey
NGAUWAOLBDDRKB-UHFFFAOYSA-N- Molecular formula
- C4H6Cl4
- Average molar mass
- 195.9 g/mol
- Monoisotopic mass
- 193.922361
Names & identifiers
- Preferred name
- 1,1,3,3-Tetrachlorobutane
- IUPAC
- 1,1,3,3-tetrachlorobutane
- English name
- 1,1,3,3-tetrachlorobutane
- Molecular formula
- C4H6Cl4
- Molecular weight
- 195.90244
Names & synonyms
1,1,3,3-tetrachlorobutane39185-82-52T3B9CJA5SEINECS 254-335-4butane, 1,1,3,3-tetrachloro-DTXSID50192424RefChem:70930DTXCID60114915254-335-4InChI=1/C4H6Cl4/c1-4(7,8)2-3(5)6/h3H,2H2,1HUNII-2T3B9CJA5SSCHEMBL1881379
Show more names
SCHEMBL5227587NGAUWAOLBDDRKB-UHFFFAOYSA-NNS00030534
Database identifiers
- CAS
39185-82-5- PubChem CID
- 642174
- DTXSID
DTXSID50192424- UNII
- 2T3B9CJA5S
- EC Number
- 254-335-4
- Nikkaji
- J87.964I
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 2
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 68.4
Physicochemical properties
- FDA UNII
- 2 T3B9CJA5S · 2T3B9CJA5S
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, 1,1,3,3-tetrachloro-
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
Loading…