chempirical

3,6-Dichloro-1,2,4,5-tetrazine

C2Cl2N4CAS 106131-61-7150.95 g/mol

Open in Covalent MOL file
NNNNClCl
Aryl halide

Properties

Molecular formula
C2Cl2N4
Molar mass
150.95 g/mol
Exact mass
149.9500 Da
logP
0.57Crippen estimate
Polar surface area
51.6 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
0

Identifiers

CAS number
106131-61-7
SMILES
C1(=NN=C(N=N1)Cl)Cl
InChIKey
HXXFMIAFWKZHDY-UHFFFAOYSA-N
InChI
InChI=1S/C2Cl2N4/c3-1-5-7-2(4)8-6-1

Weigh it out

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

Work with 3,6-Dichloro-1,2,4,5-tetrazine

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

Cyanuric chloride108-77-050 % similar 3,6-Dichloropyridazine141-30-040 % similar Dichloro-S-triazine2831-66-538 % similar 2,5-Dichloropyrimidine22536-67-035 % similar 2,4,6-Trichloropyrimidine3764-01-035 % similar 2,4,5,6-Tetrachloropyrimidine1780-40-133 % similar 2,4,6,8-Tetrachloropyrimido[5,4-D]pyrimidine32980-71-533 % similar 2-Chloro-4,6-dimethylpyrimidine4472-44-032 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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