Methyl 2-hydroxy-p-toluate
Properties
- Molecular formula
- C9H10O3
- Molar mass
- 166.18 g/mol
- Exact mass
- 166.0630 Da
- Density
- 1.1621 g/mL (at 0 °C)
- Melting point
- 27.5 °C
- Boiling point
- 243 °C
- logP
- 1.49Crippen estimate
- Polar surface area
- 46.5 Ų
- H-bond donors / acceptors
- 1 / 3
- Rotatable bonds
- 1
Identifiers
CAS number
4670-56-8SMILES
COC(=O)c1ccc(C)cc1OInChIKey
UITFCFWKYAOJEJ-UHFFFAOYSA-NInChI
InChI=1S/C9H10O3/c1-6-3-4-7(8(10)5-6)9(11)12-2/h3-5,10H,1-2H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
8 names
- Benzoic acid, 2-hydroxy-4-methyl-, methyl ester
- 2,4-Cresotic acid, methyl ester
- 2-Hydroxy-p-toluic acid methyl ester
- Methyl 2-hydroxy-4-methylbenzoate
- 2-Hydroxy-4-methylbenzoic acid methyl ester
- Methyl 4-methylsalicylate
- 2-(Methoxycarbonyl)-5-methylphenol
- 4-Methylsalicylic acid methyl ester
Work with Methyl 2-hydroxy-p-toluate
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
Methyl 5-methylsalicylate22717-57-376 % similar
Methyl 4-amino-2-hydroxybenzoate4136-97-469 % similar
Methyl 2,4-dihydroxybenzoate2150-47-269 % similar
Methyl 2-hydroxy-4-iodobenzoate18179-39-065 % similar
Methyl 4-fluoro-2-hydroxybenzoate392-04-165 % similar
Methyl 4-methoxysalicylate5446-02-665 % similar
Methyl 2-bromo-4-methylbenzoate87808-49-962 % similar
Methyl salicylate119-36-860 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds