1,1,3,3-Tetrachloro-2-methylpropane
Basic information
- CAS
54833-05-5- Standard SMILES
CC(C(Cl)Cl)C(Cl)Cl- InChIKey
RDNMWSGHMPQPAZ-UHFFFAOYSA-N- Molecular formula
- C4H6Cl4
- Average molar mass
- 195.9 g/mol
- Monoisotopic mass
- 193.922361
Overview
1,1,3,3-tetrachloro-2-methylpropane is a chloroalkane that is propane substituted by chloro groups at positions 1,1,3 and 3, respectively.
Names & identifiers
- Preferred name
- 1,1,3,3-Tetrachloro-2-methylpropane
- IUPAC
- 1,1,3,3-tetrachloro-2-methylpropane
- English name
- 2-Methyl-1,1,3,3-tetrachloropropane
- Molecular formula
- C4H6Cl4
- Molecular weight
- 195.9
Names & synonyms
1,1,3,3-Tetrachloro-2-methylpropane2-Methyl-1,1,3,3-tetrachloropropane54833-05-5CHEBI:143855DTXSID30341574RefChem:213283DTXCID50292655Propane, 1,1,3,3-tetrachloro-2-methyl-SCHEMBL27193024RDNMWSGHMPQPAZ-UHFFFAOYSA-N1,1,3,3-Tetrachloro-2-methylpropane #DB-303417
Database identifiers
- CAS
54833-05-5- PubChem CID
- 574089
- DTXSID
DTXSID30341574- ChEBI
CHEBI:143855- Nikkaji
- J102.137K
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 2
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 53.1
Physicochemical properties
- Boiling point
- 182.5 · 182.5±8.0 °C(Predicted)
- Density
- 1.387 · 1.387±0.06 g/cm3(Predicted)
Chemistry & industry
Additional notes
DefinitionChEBI: 1,1,3,3-tetrachloro-2-methylpropane is a chloroalkane that is propane substituted by chloro groups at positions 1,1,3 and 3, respectively.
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