2,3-Dimethylhydroquinone

C8H10O2CAS 608-43-5138.17 g/mol

Open in Covalent MOL file
HOOH
Phenol

Properties

Molecular formula
C8H10O2
Molar mass
138.17 g/mol
Exact mass
138.0681 Da
logP
1.71Crippen estimate
Polar surface area
40.5 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

Aggregated from 43 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
608-43-5
SMILES
CC1=C(C=CC(=C1C)O)O
InChIKey
BXJGUBZTZWCMEX-UHFFFAOYSA-N
InChI
InChI=1S/C8H10O2/c1-5-6(2)8(10)4-3-7(5)9/h3-4,9-10H,1-2H3

Weigh it out

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Work with 2,3-Dimethylhydroquinone

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

2-Methylresorcinol608-25-367 % similar Dimethylphenol1300-71-655 % similar 2,3-Dimethylphenol526-75-055 % similar 3-Chloro-2-methylphenol3260-87-552 % similar 2-Amino-o-cresol53222-92-752 % similar 3-Bromo-2-methylphenol7766-23-652 % similar 2,3-Dimethyl-4-nitrophenol19499-93-552 % similar 3-Fluoro-2-methylphenol443-87-850 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Anisyl alcohol105-13-5 1-(5-Methyl-2-furanyl)-1-propanone10599-69-6 3-Acetyl-2,5-dimethylfuran10599-70-9 4-Ethyl-1,2-benzenediol1124-39-6 2-Methoxy-5-methylphenol1195-09-1 5-Norbornene-2-carboxylic acid120-74-1 Phenoxyethanol122-99-6 3-Hydroxybenzeneethanol13398-94-2

Elsewhere

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