2,3-Dimethylnaphthalene

C₁₂H₁₂CAS 581-40-8156.23 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₂H₁₂
Molar mass: 156.23 g/mol
Exact mass: 156.0939 Da
Melting point: 105 °C
Boiling point: 268 °C
logP: 3.46Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 0

Identifiers

CAS number

581-40-8

SMILES

Cc1cc2ccccc2cc1C

InChIKey

WWGUMAYGTYQSGA-UHFFFAOYSA-N

InChI

InChI=1S/C12H12/c1-9-7-11-5-3-4-6-12(11)8-10(9)2/h3-8H,1-2H3

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

Names and synonyms

3 names

Naphthalene, 2,3-dimethyl-
Guajen
NSC 36850

Work with 2,3-Dimethylnaphthalene

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2,3,5-Trimethylnaphthalene2245-38-759 % similar Anthracene120-12-756 % similar Pentacene135-48-853 % similar Tetracene92-24-053 % similar O-Xylene95-47-653 % similar Methylnaphthalene1321-94-450 % similar 1-Methylnaphthalene90-12-050 % similar 2-Methylnaphthalene91-57-650 % similar

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

Same formula

1-Ethylnaphthalene1127-76-0 1,8-Dimethylnaphthalene569-41-5 1,4-Dimethylnaphthalene571-58-4 1,5-Dimethylnaphthalene571-61-9 1,2-Dimethylnaphthalene573-98-8 1,7-Dimethylnaphthalene575-37-1 1,3-Dimethylnaphthalene575-41-7 1,6-Dimethylnaphthalene575-43-9

Elsewhere

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