2-Chloro-4-iodo-1-methylbenzene
Properties
- Molecular formula
- C7H6ClI
- Molar mass
- 252.48 g/mol
- Exact mass
- 251.9203 Da
- Melting point
- 22 °C
- Boiling point
- 123–124 °C (at 20 Torr)
- logP
- 3.25Crippen estimate
- Polar surface area
- 0.0 Ų
- H-bond donors / acceptors
- 0 / 0
- Rotatable bonds
- 0
Hazards
Danger
- H302 Harmful if swallowed12.5% of notifiers
- H315 Causes skin irritation100% of notifiers
- H318 Causes serious eye damage12.5% of notifiers
- H319 Causes serious eye irritation87.5% of notifiers
- H335 May cause respiratory irritation75% of notifiers
- H411 Toxic to aquatic life with long lasting effects12.5% of notifiers
Aggregated from 8 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, P501
Identifiers
CAS number
83846-48-4SMILES
Cc1ccc(I)cc1ClInChIKey
PJYASWQMTNNSSL-UHFFFAOYSA-NInChI
InChI=1S/C7H6ClI/c1-5-2-3-6(9)4-7(5)8/h2-4H,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
4 names
- Benzene, 2-chloro-4-iodo-1-methyl-
- Toluene, 2-chloro-4-iodo-
- 2-Chloro-4-iodotoluene
- 1-Chloro-5-iodo-2-methylbenzene
Work with 2-Chloro-4-iodo-1-methylbenzene
Similar compounds
1,2-Dichloro-4-iodobenzene20555-91-363 % similar
Chloro-p-xylene95-72-760 % similar
1-Iodo-3,4-dimethylbenzene31599-61-858 % similar
2,4-Dichlorotoluene95-73-858 % similar
2-Chloro-1-fluoro-4-iodobenzene156150-67-354 % similar
2-Chloro-4-iodobenzenamine42016-93-354 % similar
2-Chloro-4-fluoro-1-methylbenzene452-73-354 % similar
1-Bromo-2-chloro-4-iodobenzene535934-25-954 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.