chempirical

2-Methylresorcinol

C7H8O2CAS 608-25-3124.14 g/mol

Open in Covalent MOL file
OHHO
Phenol

Properties

Molecular formula
C7H8O2
Molar mass
124.14 g/mol
Exact mass
124.0524 Da
Melting point
120 °C
Boiling point
264 °C
logP
1.41Crippen estimate
Polar surface area
40.5 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
0

Identifiers

CAS number
608-25-3
SMILES
Cc1c(O)cccc1O
InChIKey
ZTMADXFOCUXMJE-UHFFFAOYSA-N
InChI
InChI=1S/C7H8O2/c1-5-6(8)3-2-4-7(5)9/h2-4,8-9H,1H3

Weigh it out

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

Names and synonyms

10 names
  • 1,3-Benzenediol, 2-methyl-
  • Resorcinol, 2-methyl-
  • 2-Methyl-1,3-benzenediol
  • Toluene-2,6-diol
  • 2-Methylresorcin
  • 1,3-Dihydroxy-2-methylbenzene
  • 2,6-Dihydroxytoluene
  • 2-Methyl-1,3-dihydroxybenzene
  • NSC 66524
  • Rodol MRP

Work with 2-Methylresorcinol

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

Dimethylphenol1300-71-671 % similar 2,3-Dimethylphenol526-75-071 % similar 3-Chloro-2-methylphenol3260-87-568 % similar 3-Amino-2-methylphenol53222-92-768 % similar 3-Fluoro-2-methylphenol443-87-865 % similar 2-Methyl-3-nitrophenol5460-31-152 % similar Catechol120-80-950 % similar 3-Methylcatechol488-17-550 % similar

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

Same formula

2,6-Dimethyl-γ-pyrone1004-36-0 2-Acetyl-5-methylfuran1193-79-9 3-Methoxyphenol150-19-6 4-Methoxyphenol150-76-5 5-Ethyl-2-furaldehyde23074-10-4 (3Ar,6as)-3,3A,6,6A-tetrahydro-2H-cyclopenta[B]furan-2-one43119-28-4 4-Methylcatechol452-86-8 2,5-Cyclohexadiene-1-carboxylic acid4794-04-1

Elsewhere

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