2,6-Dichloro-9-methyl-9H-purine

C6H4Cl2N4CAS 2382-10-7203.03 g/mol

Open in Covalent MOL file
NNNNClCl
Aryl halide

Properties

Molecular formula
C6H4Cl2N4
Molar mass
203.03 g/mol
Exact mass
201.9813 Da
logP
1.67Crippen estimate
Polar surface area
43.6 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
2382-10-7
SMILES
CN1C=NC2=C1N=C(N=C2Cl)Cl
InChIKey
HWMJNDVUIMQFEW-UHFFFAOYSA-N
InChI
InChI=1S/C6H4Cl2N4/c1-12-2-9-3-4(7)10-6(8)11-5(3)12/h2H,1H3

Weigh it out

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

Work with 2,6-Dichloro-9-methyl-9H-purine

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

6-Chloro-9-methylpurine2346-74-961 % similar 2,4,6,8-Tetrachloropyrimido[5,4-d]pyrimidine32980-71-545 % similar (2R,3R,4S,5R)-2-(2,6-Dichloro-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol13276-52-340 % similar 9-Methyladenine700-00-539 % similar 5,7-Dichlorothiazolo(5,4-d)pyrimidine13479-88-439 % similar 2,4-Dichloropyrido[3,2-D]pyrimidine39551-54-738 % similar 2,4,6-Trichloro-5-methylpyrimidine1780-36-538 % similar 4-Bromo-1-methyl-1H-1,3-benzodiazole1353679-63-636 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2,6-Dichloro-7-methyl-7H-purine2273-93-0 4,6-Dichloro-1-methyl-1H-pyrazolo(3,4-d)pyrimidine98141-42-5

Elsewhere

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