chempirical

2,3-Dichloropropanal

C3H4Cl2OCAS 10140-89-3126.96 g/mol

Open in Covalent MOL file
OClCl
AldehydeAlkyl halide

Properties

Molecular formula
C3H4Cl2O
Molar mass
126.96 g/mol
Exact mass
125.9639 Da
Density
1.426 g/mL (at 0 °C)
Boiling point
48 °C (at 14 Torr)
logP
1.03Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
2

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
10140-89-3
SMILES
O=CC(Cl)CCl
InChIKey
IZRKUJREXIKAQM-UHFFFAOYSA-N
InChI
InChI=1S/C3H4Cl2O/c4-1-3(5)2-6/h2-3H,1H2

Weigh it out

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

Names and synonyms

4 names
  • Propanal, 2,3-dichloro-
  • Propionaldehyde, 2,3-dichloro-
  • α,β-Dichloropropionaldehyde
  • 2,3-Dichloropropionaldehyde

Work with 2,3-Dichloropropanal

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Dichloroacetaldehyde79-02-740 % similar 1,1,2-Trichloroethane79-00-533 % similar 1,2,3-Trichloropropane96-18-433 % similar Cyclopropanecarboxaldehyde1489-69-632 % similar Isobutyraldehyde78-84-232 % similar 2,3-Dichloro-1,1,1-trifluoropropane338-75-031 % similar

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

Same formula

1,1-Dichloroacetone513-88-2 Bis(chloromethyl) ketone534-07-6 3-Chloropropionyl chloride625-36-5 2-Chloropropanoyl chloride7623-09-8

Elsewhere

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