2,4,6,8-Tetrachloropyrimido[5,4-d]pyrimidine

C₆Cl₄N₄CAS 32980-71-5269.89 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₆Cl₄N₄
Molar mass: 269.89 g/mol
Exact mass: 267.8877 Da
Melting point: 254–258 °C
logP: 3.03Crippen estimate
Polar surface area: 51.6 Å²
H-bond donors / acceptors: 0 / 4
Rotatable bonds: 0

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers

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

Precautionary statements

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364

Identifiers

CAS number

32980-71-5

SMILES

Clc1nc(Cl)c2nc(Cl)nc(Cl)c2n1

InChIKey

QNKFHUMDHRWWES-UHFFFAOYSA-N

InChI

InChI=1S/C6Cl4N4/c7-3-1-2(12-6(10)13-3)4(8)14-5(9)11-1

Weigh it out

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

Names and synonyms

4 names

Pyrimido[5,4-d]pyrimidine, 2,4,6,8-tetrachloro-
Pyrimido[5,4-d]pyrimidine, tetrachloro-
Tetrachloropyrimido[5,4-d]pyrimidine
NSC 96654

Work with 2,4,6,8-Tetrachloropyrimido[5,4-d]pyrimidine

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

2,4,5,6-Tetrachloropyrimidine1780-40-158 % similar 2,4,6-Trichloro-5-methylpyrimidine1780-36-552 % similar 5,7-Dichlorothiazolo(5,4-d)pyrimidine13479-88-452 % similar Cyanuric chloride108-77-050 % similar 2,4-Dichloropyrido[3,2-D]pyrimidine39551-54-750 % similar 8-Bromo-2,4-dichloroquinazoline331647-05-348 % similar 2,4-Dichloroquinazoline607-68-148 % similar 3,5,6-Trichloro-[1,2,4]triazine873-41-648 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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