chempirical

2,6-Dimethoxynaphthalene

C12H12O2CAS 5486-55-5188.23 g/mol

Open in Covalent MOL file
OO
Ether

Properties

Molecular formula
C12H12O2
Molar mass
188.23 g/mol
Exact mass
188.0837 Da
Melting point
188 °C
logP
2.86Crippen estimate
Polar surface area
18.5 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
2

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
5486-55-5
SMILES
COc1ccc2cc(OC)ccc2c1
InChIKey
AHKDVDYNDXGFPP-UHFFFAOYSA-N
InChI
InChI=1S/C12H12O2/c1-13-11-5-3-10-8-12(14-2)6-4-9(10)7-11/h3-8H,1-2H3

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Names and synonyms

2 names
  • Naphthalene, 2,6-dimethoxy-
  • NSC 93947

Work with 2,6-Dimethoxynaphthalene

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

β-Naphthol methyl ether93-04-981 % similar 2-Bromo-6-methoxynaphthalene5111-65-971 % similar 6-Methoxy-2-naphthol5111-66-071 % similar 6-Methoxy-2-naphthaleneboronic acid156641-98-465 % similar 6-Methoxyisoquinoline52986-70-665 % similar 6-Methoxy-2-naphthaldehyde3453-33-663 % similar 6-Methoxy-2-vinylnaphthalene63444-51-963 % similar 6-Methoxynaphthalene-2-carbonitrile67886-70-863 % similar

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

Same formula

1,4-Dimethoxynaphthalene10075-62-4 2-Acetyl-1-tetralone17216-08-9 Allyl cinnamate1866-31-5 2,3-Bis(hydroxymethyl)naphthalene31554-15-1 2,7-Dimethoxynaphthalene3469-26-9 1,6-Dimethoxynaphthalene3900-49-0 3-(Phenylmethylene)-2,4-pentanedione4335-90-4 5-Phenylcyclohexane-1,3-dione493-72-1

Elsewhere

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