chempirical

3-Hydroxyphenyl benzoate

C13H10O3CAS 136-36-7214.22 g/mol

Open in Covalent MOL file
OOHO
EsterPhenol

Properties

Molecular formula
C13H10O3
Molar mass
214.22 g/mol
Exact mass
214.0630 Da
Melting point
132 °C
logP
2.61Crippen estimate
Polar surface area
46.5 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
2

Identifiers

CAS number
136-36-7
SMILES
O=C(Oc1cccc(O)c1)c1ccccc1
InChIKey
GDESWOTWNNGOMW-UHFFFAOYSA-N
InChI
InChI=1S/C13H10O3/c14-11-7-4-8-12(9-11)16-13(15)10-5-2-1-3-6-10/h1-9,14H

Weigh it out

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

Names and synonyms

12 names
  • Resorcinol, monobenzoate
  • 1,3-Benzenediol, 1-benzoate
  • 1,3-Benzenediol, monobenzoate
  • Resorcinol, benzoate
  • Eastman inhibitor RMB
  • 1,3-Benzenediol benzoate
  • Seesorb 300
  • m-Hydroxyphenyl benzoate
  • Eastman RMB
  • RMB
  • 3-Benzoyloxyphenol
  • NSC 4807

Work with 3-Hydroxyphenyl benzoate

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

1,3-Phenylene dibenzoate94-01-974 % similar p-Hydroxyphenyl benzoate2444-19-168 % similar Phenyl benzoate93-99-265 % similar Diphenyl isophthalate744-45-664 % similar 1,4-Diphenyl 1,4-benzenedicarboxylate1539-04-459 % similar Acetylresorcinol102-29-457 % similar β-Naphthyl benzoate93-44-757 % similar p-Chlorophenyl benzoate2005-08-554 % similar

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

Same formula

Diphenyl carbonate102-09-0 3,4-Dihydroxybenzophenone10425-11-3 Phenyl salicylate118-55-8 2,4-Dihydroxybenzophenone131-56-6 4-Acetyl-1-naphthalenecarboxylic acid131986-05-5 Phenyl 4-hydroxybenzoate17696-62-7 4-Phenoxybenzoic acid2215-77-2 2-Phenoxybenzoic acid2243-42-7

Elsewhere

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