1,2-Dichloro-2-methylpropane

C₄H₈Cl₂CAS 594-37-6127.01 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₄H₈Cl₂
Molar mass: 127.01 g/mol
Exact mass: 126.0003 Da
Density: 1.093 g/mL (at 20 °C)
Boiling point: 106.5 °C
logP: 2.24Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 1

Identifiers

CAS number

594-37-6

SMILES

CC(C)(Cl)CCl

InChIKey

OQPNDCHKFIHPBY-UHFFFAOYSA-N

InChI

InChI=1S/C4H8Cl2/c1-4(2,6)3-5/h3H2,1-2H3

Weigh it out

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

Names and synonyms

5 names

Propane, 1,2-dichloro-2-methyl-
(Chloromethyl)chlorodimethylmethane
NSC 166449
2-Methyl-1,2-dichloropropane
1,2-Dichloroisobutane

Work with 1,2-Dichloro-2-methylpropane

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

2,5-Dichloro-2,5-dimethylhexane6223-78-553 % similar tert-Amyl chloride594-36-547 % similar 1-Chloro-2,2-dimethylpropane753-89-944 % similar 1,2-Dichloro-2-fluoropropane420-97-341 % similar 1,2,2,3-Tetrachloropropane13116-53-539 % similar 1,1,1,2-Tetrachloroethane630-20-639 % similar 1-Chloro-2-methyl-2-propanol558-42-938 % similar 1,3-Dichloro-2,2-bis(chloromethyl)propane3228-99-735 % similar

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

Same formula

1,4-Dichlorobutane110-56-5 1,3-Dichlorobutane1190-22-3 1,2-Dichlorobutane616-21-7 2,3-Dichlorobutane7581-97-7

Elsewhere

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