2-Chloro-5-iodopyrimidine

C4H2ClIN2CAS 32779-38-7240.43 g/mol

Open in Covalent MOL file
NNClI
Aryl halide

Properties

Molecular formula
C4H2ClIN2
Molar mass
240.43 g/mol
Exact mass
239.8951 Da
logP
1.73Crippen estimate
Polar surface area
25.8 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
0

Hazards

Danger
Corrosive (GHS05)Irritant (GHS07)

Aggregated from 3 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
32779-38-7
SMILES
C1=C(C=NC(=N1)Cl)I
InChIKey
WSZRCNZXKKTLQE-UHFFFAOYSA-N
InChI
InChI=1S/C4H2ClIN2/c5-4-7-1-3(6)2-8-4/h1-2H

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with 2-Chloro-5-iodopyrimidine

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2,5-Dichloropyrimidine22536-67-050 % similar 2-Chloro-5-iodopyridine69045-79-050 % similar 2-Chloro-5-methylpyrimidine22536-61-445 % similar 5-Bromo-2-chloropyrimidine32779-36-545 % similar 2-Chloro-5-hydroxypyrimidine4983-28-245 % similar 2-Chloropyrimidin-5-amine56621-90-045 % similar 2-Chloro-5-fluoropyrimidine62802-42-045 % similar 5-Iodopyrimidine31462-58-543 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3-Chloro-6-iodopyridazine135034-10-5 4-Chloro-5-iodopyrimidine63558-65-6 5-Chloro-2-iodopyrimidine874676-81-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook