2,5-Dichlorotoluene

C₇H₆Cl₂CAS 19398-61-9161.02 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₇H₆Cl₂
Molar mass: 161.02 g/mol
Exact mass: 159.9847 Da
Melting point: 5 °C
Boiling point: 200 °C
logP: 3.30Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 0

Hazards

Warning

H332 Harmful if inhaled47.6% of notifiers

Aggregated from 82 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P271, P304+P340, P317

Identifiers

CAS number

19398-61-9

SMILES

Cc1cc(Cl)ccc1Cl

InChIKey

KFAKZJUYBOYVKA-UHFFFAOYSA-N

InChI

InChI=1S/C7H6Cl2/c1-5-4-6(8)2-3-7(5)9/h2-4H,1H3

Weigh it out

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

Names and synonyms

4 names

Benzene, 1,4-dichloro-2-methyl-
Toluene, 2,5-dichloro-
1,4-Dichloro-2-methylbenzene
NSC 86117

Work with 2,5-Dichlorotoluene

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-Chloro-1,2-dimethylbenzene615-60-165 % similar 4-Chloro-M-xylene95-66-960 % similar 1-Chloro-4-iodo-2-methylbenzene116632-41-858 % similar 4-Chloro-1-iodo-2-methylbenzene23399-70-458 % similar 4-Chloro-o-toluidine95-69-258 % similar 4-Chloro-1-methoxy-2-methylbenzene3260-85-357 % similar 1,2,4-Trichlorobenzene120-82-157 % similar 1-Bromo-4-chloro-2-methylbenzene14495-51-356 % similar

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

Same formula

4-Chlorobenzyl chloride104-83-6 2,6-Dichlorotoluene118-69-4 Benzal chloride29797-40-8 2,3-Dichlorotoluene32768-54-0 2-Chlorobenzyl chloride611-19-8 m,Alpha-Dichlorotoluene620-20-2 2,4-Dichlorotoluene95-73-8 3,4-Dichlorotoluene95-75-0

Elsewhere

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