2,8-Dimethyldibenzothiophene

C₁₄H₁₂SCAS 1207-15-4212.31 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₄H₁₂S
Molar mass: 212.31 g/mol
Exact mass: 212.0660 Da
logP: 4.67Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 0

Identifiers

CAS number

1207-15-4

SMILES

CC1=CC2=C(C=C1)SC3=C2C=C(C=C3)C

InChIKey

RRYWCJRYULRSJM-UHFFFAOYSA-N

InChI

InChI=1S/C14H12S/c1-9-3-5-13-11(7-9)12-8-10(2)4-6-14(12)15-13/h3-8H,1-2H3

Weigh it out

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

Work with 2,8-Dimethyldibenzothiophene

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

3,6-Dimethylphenanthrene1576-67-652 % similar 3-Chloro-5-methylbenzo[B]thiophene-2-sulfonamide175203-94-847 % similar 2,5-Dimethylbenzothiazole95-26-147 % similar 5-Methylbenzo[B]thiophene14315-14-146 % similar 3,6-Dimethylcarbazole5599-50-846 % similar 5-Methyl-2-benzothiazolamine14779-17-045 % similar 2,6-Dimethylnaphthalene581-42-043 % similar 2,6-Dimethylbenzothiazole2941-71-142 % similar

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

Same formula

4,6-Dimethyldibenzothiophene1207-12-1

Elsewhere

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