Basic information
- CAS
812-03-3- Standard SMILES
CC(Cl)C(Cl)(Cl)Cl- InChIKey
FEKGWIHDBVDVSM-UHFFFAOYSA-N- Molecular formula
- C3H4Cl4
- Average molar mass
- 181.9 g/mol
- Monoisotopic mass
- 179.90671085
Names & identifiers
- Preferred name
- 1,1,1,2-Tetrachloropropane
- IUPAC
- 1,1,1,2-tetrachloropropane
- English name
- 1,1,1,2-TETRACHLOROPROPANE
- Molecular formula
- C3H4Cl4
- Molecular weight
- 181.88
Names & synonyms
1,1,1,2-TETRACHLOROPROPANEPropane, 1,1,1,2-tetrachloro-CH3CHClCCl3EINECS 212-381-2DTXSID10870776RefChem:70827DTXCID50818470212-381-2FEKGWIHDBVDVSM-UHFFFAOYSA-N812-03-3VW2JA99E7PSCHEMBL562402
Show more names
1,1,1,2-tetrachloro-propanpropane,1,1,1,2-tetrachloro-
1,1,1,2-tetrachloro-propaneSCHEMBL11257814AKOS006283790DB-056501NS00042301
Database identifiers
- CAS
812-03-3- PubChem CID
- 13131
- DTXSID
DTXSID10870776- UNII
- VW2JA99E7P
- EC Number
- 212-381-2
- Nikkaji
- J543F
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 54.4
Experimental & physicochemical properties
SpringerMaterials PropertiesBoiling point
Physicochemical properties
- Melting point
- -65 °C · -65°C
- Boiling point
- 169.56 °C · 169.56°C (estimate)
- Density
- 1.465 · 1.4650
- refractive index
- 1.4837 · 1.4837
- CAS DataBase Reference
- 812 · 812-03-3
- EPA Substance Registry System
- 1 · Propane, 1,1,1,2-tetrachloro- (812-03-3)
- TSCA
- TSCA listed
Safety & regulation
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationPropane, 1,1,1,2-tetrachloro-: ACTIVE
Suppliers2 total
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
1 records
Compound notes
Loading…