chempirical

4-Methylresorcinol

C7H8O2CAS 496-73-1124.14 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
106 °C
Boiling point
268.5 °C
logP
1.41Crippen estimate
Polar surface area
40.5 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
0

Identifiers

CAS number
496-73-1
SMILES
Cc1ccc(O)cc1O
InChIKey
FNYDIAAMUCQQDE-UHFFFAOYSA-N
InChI
InChI=1S/C7H8O2/c1-5-2-3-6(8)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

11 names
  • 1,3-Benzenediol, 4-methyl-
  • Resorcinol, 4-methyl-
  • 4-Methyl-1,3-benzenediol
  • Cresorcinol
  • 2,4-Dihydroxyphenylmethane
  • 2,4-Dihydroxytoluene
  • 2,4-Toluenediol
  • 1,3-Dihydroxy-4-methylbenzene
  • NKO 10
  • 4-Methylresorcin
  • 4-Methyl-1,3-dihydroxybenzene

Work with 4-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

Methylhydroquinone95-71-667 % similar 3,4-Xylenol95-65-865 % similar 2,5-Dimethylphenol95-87-460 % similar Hydroxyquinol533-73-357 % similar 5-Amino-2-methylphenol2835-95-256 % similar 3-Amino-4-methylphenol2836-00-256 % similar 3-Fluoro-4-methylphenol452-78-856 % similar 5-Fluoro-2-methylphenol452-85-756 % 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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