1,2-Diethoxybenzene

C₁₀H₁₄O₂CAS 2050-46-6166.22 g/mol

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Properties

Molecular formula: C₁₀H₁₄O₂
Molar mass: 166.22 g/mol
Exact mass: 166.0994 Da
Density: 1.0169 g/mL (at 20 °C)
Melting point: 44 °C
Boiling point: 219 °C
logP: 2.48Crippen estimate
Polar surface area: 18.5 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 4

Identifiers

CAS number

2050-46-6

SMILES

CCOc1ccccc1OCC

InChIKey

QZYDOKBVZJLQCK-UHFFFAOYSA-N

InChI

InChI=1S/C10H14O2/c1-3-11-9-7-5-6-8-10(9)12-4-2/h5-8H,3-4H2,1-2H3

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Names and synonyms

5 names

Benzene, 1,2-diethoxy-
Benzene, o-diethoxy-
o-Diethoxybenzene
Catechol diethyl ether
NSC 6189

Work with 1,2-Diethoxybenzene

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

1-(2-Bromoethoxy)-2-ethoxybenzene3259-03-874 % similar 1-Ethoxy-2-fluorobenzene451-80-967 % similar 1-Chloro-2-ethoxybenzene614-72-267 % similar 2-Ethoxyaniline94-70-267 % similar 2-Ethoxyphenol94-71-367 % similar 1-Ethoxynaphthalene5328-01-864 % similar Benzodioxan493-09-463 % similar 2-Ethoxybenzenemethanamine37806-29-462 % similar

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

Same formula

Phenylacetaldehyde dimethyl acetal101-48-4 (-)-Camphorquinone10334-26-6 Camphorquinone10373-78-1 4-Butoxyphenol122-94-1 1,4-Diethoxybenzene122-95-2 2-Hexanoylfuran14360-50-0 Hexahydro-2,5-methanopentalene-3A(1H)-carboxylic acid16200-53-6 4-Butylresorcinol18979-61-8

Elsewhere

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