2,3,5-Trichlorobenzaldehyde

C7H3Cl3OCAS 56961-75-2209.45 g/mol

Open in Covalent MOL file
OClClCl
AldehydeAryl halide

Properties

Molecular formula
C7H3Cl3O
Molar mass
209.45 g/mol
Exact mass
207.9249 Da
Melting point
56 °C
logP
3.46Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
1

Hazards

Danger
Corrosive (GHS05)

Aggregated from 41 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, P501

Identifiers

CAS number
56961-75-2
SMILES
O=Cc1cc(Cl)cc(Cl)c1Cl
InChIKey
DJYRZTCLVDKWBL-UHFFFAOYSA-N
InChI
InChI=1S/C7H3Cl3O/c8-5-1-4(3-11)7(10)6(9)2-5/h1-3H

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Names and synonyms

1 names
  • Benzaldehyde, 2,3,5-trichloro-

Work with 2,3,5-Trichlorobenzaldehyde

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

3,5-Dichlorosalicylaldehyde90-60-861 % similar 2,3-Dichlorobenzaldehyde6334-18-559 % similar 2,5-Dichlorobenzaldehyde6361-23-557 % similar 2,4-Dichlorobenzaldehyde874-42-057 % similar 1,2,3,5-Tetrachlorobenzene634-90-256 % similar 2,4-Dichloro-6-fluorobenzaldehyde681435-09-647 % similar 2,4-Dichloro-6-hydroxybenzaldehyde78443-72-847 % similar 2-Chlorobenzaldehyde89-98-547 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2,4,6-Trichlorobenzaldehyde24473-00-5 2,3-Dichlorobenzoyl chloride2905-60-4 2,5-Dichlorobenzoyl chloride2905-61-5 3,5-Dichlorobenzoyl chloride2905-62-6 3,4-Dichlorobenzoyl chloride3024-72-4 2,6-Dichlorobenzoyl chloride4659-45-4 2,3,6-Trichlorobenzaldehyde4659-47-6 2,4-Dichlorobenzoyl chloride89-75-8

Elsewhere

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