chempirical

3,4-Dichlorobenzaldehyde

C7H4Cl2OCAS 6287-38-3175.01 g/mol

Open in Covalent MOL file
OClCl
AldehydeAryl halide

Properties

Molecular formula
C7H4Cl2O
Molar mass
175.01 g/mol
Exact mass
173.9639 Da
Melting point
44 °C
Boiling point
247.5 °C
logP
2.81Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
1

Identifiers

CAS number
6287-38-3
SMILES
O=Cc1ccc(Cl)c(Cl)c1
InChIKey
ZWUSBSHBFFPRNE-UHFFFAOYSA-N
InChI
InChI=1S/C7H4Cl2O/c8-6-2-1-5(4-10)3-7(6)9/h1-4H

Weigh it out

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

Names and synonyms

5 names
  • Benzaldehyde, 3,4-dichloro-
  • 3,4-Dichlorobenzenecarboxaldehyde
  • m,p-Dichlorobenzaldehyde
  • NSC 8763
  • 3,4-Dichlorobenzaldehlyde

Work with 3,4-Dichlorobenzaldehyde

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

4-Bromo-3-chlorobenzaldehyde120077-69-264 % similar 3-Chloro-4-hydroxybenzaldehyde2420-16-864 % similar 3-Chloro-4-fluorobenzaldehyde34328-61-564 % similar 4-Chloro-3-fluorobenzaldehyde5527-95-764 % similar 4-Chloro-3-methoxybenzaldehyde13726-16-458 % similar 4-Chloro-3-(trifluoromethyl)benzaldehyde34328-46-658 % similar 3-Chloro-4-methoxybenzaldehyde4903-09-758 % similar 4-Chloro-3-nitrobenzaldehyde16588-34-455 % similar

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

Same formula

3,5-Dichlorobenzaldehyde10203-08-4 4-Chlorobenzoyl chloride122-01-0 2-Chlorobenzoyl chloride609-65-4 3-Chlorobenzoyl chloride618-46-2 2,3-Dichlorobenzaldehyde6334-18-5 2,5-Dichlorobenzaldehyde6361-23-5 2,6-Dichlorobenzaldehyde83-38-5 2,4-Dichlorobenzaldehyde874-42-0

Elsewhere

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