2-Methoxybenzene-1,4-diol

C₇H₈O₃CAS 824-46-4140.14 g/mol

Open in Covalent MOL file

Ether Phenol

Properties

Molecular formula: C₇H₈O₃
Molar mass: 140.14 g/mol
Exact mass: 140.0473 Da
Melting point: 89–91 °C
Boiling point: 180 °C (at 24 Torr)
logP: 1.11Crippen estimate
Polar surface area: 49.7 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 1

Hazards

Warning

H302 Harmful if swallowed14.3% of notifiers
H315 Causes skin irritation85.7% of notifiers
H319 Causes serious eye irritation85.7% of notifiers
H335 May cause respiratory irritation71.4% of notifiers
H400 Very toxic to aquatic life14.3% of notifiers

Aggregated from 7 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, P501

Identifiers

CAS number

824-46-4

SMILES

COc1cc(O)ccc1O

InChIKey

LAQYHRQFABOIFD-UHFFFAOYSA-N

InChI

InChI=1S/C7H8O3/c1-10-7-4-5(8)2-3-6(7)9/h2-4,8-9H,1H3

Weigh it out

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

Names and synonyms

15 names · show all

2-Methoxyhydroquinone
1,4-Benzenediol, 2-methoxy-
Hydroquinone, methoxy-
2-Methoxy-1,4-benzenediol
Methoxy-p-benzohydroquinone
Methoxyhydroquinone
Methoxyquinol
o-Methoxyhydroquinone
2,5-Dihydroxyanisole
1,4-Dihydroxy-3-methoxybenzene
1,4-Dihydroxy-2-methoxybenzene
Monomethoxyhydroquinone
3-Methoxy-1,4-benzenediol
4-Hydroxy-2-methoxyphenol
2-Methoxy-1,4-dihydroxybenzene

Work with 2-Methoxybenzene-1,4-diol

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

3,4-Dimethoxyphenol2033-89-869 % similar 4-Bromo-2-methoxyphenol7368-78-766 % similar Creosol93-51-662 % similar 4-Bromo-3-methoxyphenol102127-34-460 % similar 4-Chloro-2-methoxyphenol16766-30-660 % similar 4-Fluoro-2-methoxyphenol450-93-160 % similar 4-Amino-2-methoxyphenol52200-90-560 % similar 4-Hydroxy-2-methoxybenzaldehyde18278-34-759 % similar

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

Same formula

Ethyl 2-furoate1335-40-6 5-Methoxyresorcinol2174-64-3 Methyl 5-methyl-2-furancarboxylate2527-96-0 3,5-Dihydroxybenzyl alcohol29654-55-5 Rel-(3aR,6aS)-Tetrahydro-1H-cyclopenta[c]furan-1,3(3aH)-dione35878-28-5 2-Acetyl-1,3-cyclopentanedione3859-39-0 3,4-Dihydroxybenzyl alcohol3897-89-0 Ethyl maltol4940-11-8

Elsewhere

PubChem CAS Common Chemistry NIST WebBook