1,2,2,3-Tetrachloropropane

C₃H₄Cl₄CAS 13116-53-5181.87 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₃H₄Cl₄
Molar mass: 181.87 g/mol
Exact mass: 179.9067 Da
Density: 1.5 g/mL (at 18 °C)
Boiling point: 165 °C
logP: 2.64Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 2

Identifiers

CAS number

13116-53-5

SMILES

ClCC(Cl)(Cl)CCl

InChIKey

UDPHJTAYHSSOQB-UHFFFAOYSA-N

InChI

InChI=1S/C3H4Cl4/c4-1-3(6,7)2-5/h1-2H2

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

2 names

Propane, 1,2,2,3-tetrachloro-
HCC 250AA

Work with 1,2,2,3-Tetrachloropropane

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

1,1,1,2-Tetrachloroethane630-20-647 % similar 1,3-Dichloro-2,2-bis(chloromethyl)propane3228-99-743 % similar 1,2-Dichloro-1,1-difluoroethane1649-08-739 % similar 1,2-Dichloro-2-methylpropane594-37-639 % similar 2-Chloro-1,1,1-trifluoroethane75-88-735 % similar 1-Chloro-2,2-dimethylpropane753-89-935 % similar 1,1,2,2,3-Pentachloropropane16714-68-435 % similar 1,2-Dichloro-2-fluoropropane420-97-333 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

1,1,1,3-Tetrachloropropane1070-78-6

Elsewhere

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