2,4,6-Trichlorobenzonitrile
Properties
- Molecular formula
- C7H2Cl3N
- Molar mass
- 206.45 g/mol
- Exact mass
- 204.9253 Da
- logP
- 3.52Crippen estimate
- Polar surface area
- 23.8 Ų
- H-bond donors / acceptors
- 0 / 1
- Rotatable bonds
- 0
Hazards
Danger
- H301 Toxic if swallowed16.7% of notifiers
- H302 Harmful if swallowed66.7% of notifiers
- H311 Toxic in contact with skin16.7% of notifiers
- H312 Harmful in contact with skin66.7% of notifiers
- H315 Causes skin irritation83.3% of notifiers
- H319 Causes serious eye irritation83.3% of notifiers
- H331 Toxic if inhaled16.7% of notifiers
- H332 Harmful if inhaled66.7% of notifiers
- H335 May cause respiratory irritation83.3% of notifiers
Aggregated from 6 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
6575-05-9SMILES
C1=C(C=C(C(=C1Cl)C#N)Cl)ClInChIKey
PGODHCIOIPODFE-UHFFFAOYSA-NInChI
InChI=1S/C7H2Cl3N/c8-4-1-6(9)5(3-11)7(10)2-4/h1-2HWeigh it out
Type any one amount. The others follow from the molar mass.
Work with 2,4,6-Trichlorobenzonitrile
Similar compounds
2,6-Dichlorobenzonitrile1194-65-665 % similar
4-Bromo-2,6-dichlorobenzonitrile99835-27-562 % similar
2,6-Dichloro-4-(trifluoromethyl)benzonitrile157021-61-955 % similar
2,4-Dichlorobenzonitrile6574-98-754 % similar
2-Amino-3,5-dichlorobenzonitrile36764-94-053 % similar
3,5-Dichlorobenzonitrile6575-00-452 % similar
3,5-Dichloro-2-cyanopyridine85331-33-550 % similar
2,5-Dichlorobenzonitrile21663-61-648 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.