3,4-Dimethoxyphenol
Properties
- Molecular formula
- C8H10O3
- Molar mass
- 154.16 g/mol
- Exact mass
- 154.0630 Da
- Melting point
- 79–80 °C
- Boiling point
- 168–170 °C
- logP
- 1.41Crippen estimate
- Polar surface area
- 38.7 Ų
- H-bond donors / acceptors
- 1 / 3
- Rotatable bonds
- 2
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation97.8% of notifiers
Aggregated from 45 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
2033-89-8SMILES
COc1ccc(O)cc1OCInChIKey
SMFFZOQLHYIRDA-UHFFFAOYSA-NInChI
InChI=1S/C8H10O3/c1-10-7-4-3-6(9)5-8(7)11-2/h3-5,9H,1-2H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
3 names
- Phenol, 3,4-dimethoxy-
- NSC 140927
- 3,4-Bis(methyloxy)phenol
Work with 3,4-Dimethoxyphenol
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-Methoxybenzene-1,4-diol824-46-469 % similar
4-Bromo-3-methoxyphenol102127-34-464 % similar
3-Fluoro-4-methoxyphenol452-11-964 % similar
4-Hydroxy-2-methoxybenzaldehyde18278-34-758 % similar
2,6-Dimethoxyhydroquinone15233-65-558 % similar
3,4,5-Trimethoxyphenol642-71-758 % similar
Bromoveratrole2859-78-156 % similar
1,2,4-Trimethoxybenzene135-77-354 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.