2,5-Dichloropyrimidine
Properties
- Molecular formula
- C4H2Cl2N2
- Molar mass
- 148.97 g/mol
- Exact mass
- 147.9595 Da
- Melting point
- 57–57.5 °C
- Boiling point
- 190 °C
- logP
- 1.78Crippen estimate
- Polar surface area
- 25.8 Ų
- H-bond donors / acceptors
- 0 / 2
- Rotatable bonds
- 0
Hazards
Danger
- H302 Harmful if swallowed93.6% of notifiers
- H318 Causes serious eye damage91.5% of notifiers
- H400 Very toxic to aquatic life89.4% of notifiers
Aggregated from 47 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P264, P264+P265, P270, P273, P280, P301+P317, P305+P354+P338, P317, P330, P391, P501
Identifiers
CAS number
22536-67-0SMILES
Clc1cnc(Cl)nc1InChIKey
CEJAHXLRNZJPQH-UHFFFAOYSA-NInChI
InChI=1S/C4H2Cl2N2/c5-3-1-7-4(6)8-2-3/h1-2HWeigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
2 names
- Pyrimidine, 2,5-dichloro-
- 2-Chloro-5-chloropyrimidine
Work with 2,5-Dichloropyrimidine
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
2-Chloro-5-(4-chlorophenyl)pyrimidine27956-40-762 % similar
2-Bromo-5-chloropyrimidine124405-67-055 % similar
5-Chloro-2(1H)-pyrimidinone54326-16-855 % similar
5-Chloro-2-iodopyrimidine874676-81-055 % similar
2-Chloro-5-methylpyrimidine22536-61-450 % similar
5-Bromo-2-chloropyrimidine32779-36-550 % similar
2-Chloro-5-iodopyrimidine32779-38-750 % similar
2-Chloro-5-hydroxypyrimidine4983-28-250 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.