3,5-Dichloro-2,4,6-trifluoropyridine
Properties
- Molecular formula
- C5Cl2F3N
- Molar mass
- 201.96 g/mol
- Exact mass
- 200.9360 Da
- Boiling point
- 159–160 °C
- logP
- 2.81Crippen estimate
- Polar surface area
- 12.9 Ų
- H-bond donors / acceptors
- 0 / 1
- Rotatable bonds
- 0
Hazards
Danger
- H301 Toxic if swallowed17.8% of notifiers
- H310+H330 Fatal in contact with skin or if inhaled13.6% of notifiers
- H310 Fatal in contact with skin18.6% of notifiers
- H315 Causes skin irritation99.2% of notifiers
- H317 May cause an allergic skin reaction13.6% of notifiers
- H319 Causes serious eye irritation82.2% of notifiers
- H330 Fatal if inhaled51.7% of notifiers
- H335 May cause respiratory irritation84.7% of notifiers
- H400 Very toxic to aquatic life16.9% of notifiers
- H410 Very toxic to aquatic life with long lasting effects16.9% of notifiers
Aggregated from 118 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P260, P261, P262, P264, P264+P265, P270, P271, P272, P273, P280, P284, P301+P316, P302+P352, P304+P340, P305+P351+P338, P316, P319, P320, P321, P330, P332+P317, P333+P317, P337+P317, P361+P364, P362+P364, P391, P403+P233, P405, P501
Identifiers
CAS number
1737-93-5SMILES
Fc1nc(F)c(Cl)c(F)c1ClInChIKey
PKSORSNCSXBXOT-UHFFFAOYSA-NInChI
InChI=1S/C5Cl2F3N/c6-1-3(8)2(7)5(10)11-4(1)9Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
3 names
- Pyridine, 3,5-dichloro-2,4,6-trifluoro-
- 2,4,6-Trifluoro-3,5-dichloropyridine
- 3,5-Dichlorotrifluoropyridine
Work with 3,5-Dichloro-2,4,6-trifluoropyridine
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
3-Chloro-2,4,5,6-tetrafluoropyridine1735-84-880 % similar
3,5-Dichloro-2,6-difluoro-4-pyridinamine2840-00-857 % similar
1,3,5-Trichloro-2,4,6-trifluorobenzene319-88-056 % similar
5-Chloro-2,4,6-trifluoropyrimidine697-83-655 % similar
1,3-Dichloro-2,4,5,6-tetrafluorobenzene1198-61-450 % similar
Pentafluoropyridine700-16-350 % similar
Chloropentafluorobenzene344-07-045 % similar
4-Amino-2,3,5,6-tetrafluoropyridine1682-20-842 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.