1,1,1,2-Tetrachloroethane
Properties
- Molecular formula
- C2H2Cl4
- Molar mass
- 167.84 g/mol
- Exact mass
- 165.8911 Da
- Density
- 1.5406 g/mL (at 20 °C)
- Melting point
- −70.2 °C
- Boiling point
- 130.5 °C
- Water solubility
- 2.83 g/L (25 °C)
- logP
- 2.60Crippen estimate
- Polar surface area
- 0.0 Ų
- H-bond donors / acceptors
- 0 / 0
- Rotatable bonds
- 0
Hazards
Danger
- H302 Harmful if swallowed78.6% of notifiers
- H310 Fatal in contact with skin42.9% of notifiers
- H318 Causes serious eye damage35.7% of notifiers
- H319 Causes serious eye irritation42.9% of notifiers
- H331 Toxic if inhaled57.1% of notifiers
- H332 Harmful if inhaled21.4% of notifiers
- H351 Suspected of causing cancer28.6% of notifiers
- H412 Harmful to aquatic life with long lasting effects21.4% of notifiers
Aggregated from 14 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P203, P261, P262, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P318, P321, P330, P337+P317, P361+P364, P403+P233, P405, P501
Identifiers
CAS number
630-20-6SMILES
ClCC(Cl)(Cl)ClInChIKey
QVLAWKAXOMEXPM-UHFFFAOYSA-NInChI
InChI=1S/C2H2Cl4/c3-1-2(4,5)6/h1H2Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
6 names
- HCC 130a
- F 130a
- Tetrachloroethane
- Ethane, 1,1,1,2-tetrachloro-
- (Chloromethyl)trichloromethane
- TCA
Work with 1,1,1,2-Tetrachloroethane
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
1,2,2,3-Tetrachloropropane13116-53-547 % similar
1,3-Dichloro-2,2-bis(chloromethyl)propane3228-99-743 % similar
1,1,1,3-Tetrachloropropane1070-78-641 % similar
1,2-Dichloro-1,1-difluoroethane1649-08-739 % similar
1,2-Dichloro-2-methylpropane594-37-639 % similar
Trichloroethyl alcohol115-20-835 % similar
2,2-Dimethyl-1,3-dichloropropane29559-55-535 % similar
2-Chloro-1,1,1-trifluoroethane75-88-735 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.