chempirical

2,5-Dimethylresorcin

C8H10O2CAS 488-87-9138.17 g/mol

Open in Covalent MOL file
OHOH
Phenol

Properties

Molecular formula
C8H10O2
Molar mass
138.17 g/mol
Exact mass
138.0681 Da
Melting point
163 °C
Boiling point
278.5 °C
logP
1.71Crippen estimate
Polar surface area
40.5 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
0

Identifiers

CAS number
488-87-9
SMILES
Cc1cc(O)c(C)c(O)c1
InChIKey
GHVHDYYKJYXFGU-UHFFFAOYSA-N
InChI
InChI=1S/C8H10O2/c1-5-3-7(9)6(2)8(10)4-5/h3-4,9-10H,1-2H3

Weigh it out

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

Names and synonyms

8 names
  • 1,3-Benzenediol, 2,5-dimethyl-
  • Resorcinol, 2,5-dimethyl-
  • 2,5-Dimethyl-1,3-benzenediol
  • β-Orcinol
  • p-Xylorcinol
  • 2,5-Dimethylresorcinol
  • 4-Methylorcinol
  • 2,5-Dimethyl-1,3-dihydroxybenzene

Work with 2,5-Dimethylresorcin

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

2,3,5-Trimethylphenol697-82-573 % similar 4-Methylcatechol452-86-852 % similar 2-Methylresorcinol608-25-350 % similar 2,5-Dimethylphenol95-87-448 % similar 3,5-Dihydroxy-4-methylbenzoic acid28026-96-246 % similar 2,6-Dihydroxy-4-methylbenzoic acid480-67-146 % similar Trimethylhydroquinone700-13-046 % similar 3,5-Dimethylphenol108-68-945 % 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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