2,4-Dichlorotoluene
Properties
- Molecular formula
- C7H6Cl2
- Molar mass
- 161.03 g/mol
- Exact mass
- 159.9847 Da
- Density
- 1.2476 g/mL (at 20 °C)
- Melting point
- −13.5 °C
- Boiling point
- 201 °C
- Flash point
- 87 °C (closed cup)
- logP
- 3.30Crippen estimate
- Polar surface area
- 0.0 Ų
- H-bond donors / acceptors
- 0 / 0
- Rotatable bonds
- 0
Hazards
Warning
- H315 Causes skin irritation27.5% of notifiers
- H336 May cause drowsiness or dizziness20.3% of notifiers
- H361f Suspected of damaging fertility18.8% of notifiers
- H411 Toxic to aquatic life with long lasting effects91.3% of notifiers
Aggregated from 69 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P203, P261, P264, P271, P273, P280, P302+P352, P304+P340, P318, P319, P321, P332+P317, P362+P364, P391, P403+P233, P405, P501
Identifiers
CAS number
95-73-8SMILES
Cc1ccc(Cl)cc1ClInChIKey
FUNUTBJJKQIVSY-UHFFFAOYSA-NInChI
InChI=1S/C7H6Cl2/c1-5-2-3-6(8)4-7(5)9/h2-4H,1H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
5 names
- Benzene, 2,4-dichloro-1-methyl-
- Toluene, 2,4-dichloro-
- 2,4-Dichloro-1-methylbenzene
- 1,3-Dichloro-4-methylbenzene
- NSC 8764
Work with 2,4-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
Chloro-p-xylene95-72-763 % similar
4-Chloro-2-iodotoluene33184-48-458 % similar
2-Chloro-4-iodo-1-methylbenzene83846-48-458 % similar
1,2,4-Trichlorobenzene120-82-157 % similar
2-Bromo-4-chloro-1-methylbenzene27139-97-556 % similar
2-Chloro-4-fluoro-1-methylbenzene452-73-356 % similar
4-Chloro-2-fluoro-1-methylbenzene452-75-556 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds