5-Methoxyresorcinol

C7H8O3CAS 2174-64-3140.14 g/mol

Open in Covalent MOL file
OOHOH
EtherPhenol

Properties

Molecular formula
C7H8O3
Molar mass
140.14 g/mol
Exact mass
140.0473 Da
Melting point
80.3 °C
Boiling point
187–189 °C (at 12 Torr)
logP
1.11Crippen estimate
Polar surface area
49.7 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
2174-64-3
SMILES
COc1cc(O)cc(O)c1
InChIKey
HDVRLUFGYQYLFJ-UHFFFAOYSA-N
InChI
InChI=1S/C7H8O3/c1-10-7-3-5(8)2-6(9)4-7/h2-4,8-9H,1H3

Weigh it out

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

Names and synonyms

12 names
  • 1,3-Benzenediol, 5-methoxy-
  • Resorcinol, 5-methoxy-
  • 5-Methoxy-1,3-benzenediol
  • 1,3-Dihydroxy-5-methoxybenzene
  • Phloroglucinol monomethyl ether
  • O-Methylphloroglucinol
  • Flamenol
  • 1-Methoxy-3,5-benzenediol
  • Monomethylphloroglucinol
  • 3-Hydroxy-5-methoxyphenol
  • 3,5-Dihydroxyanisole
  • 5-Methoxybenzene-1,3-diol

Work with 5-Methoxyresorcinol

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

3,5-Dimethoxyphenol500-99-289 % similar 3-Methoxy-5-methylphenol3209-13-071 % similar 3-Chloro-5-methoxyphenol65262-96-668 % similar 3-Methoxyphenol150-19-660 % similar 1,3,5-Trimethoxybenzene621-23-858 % similar Pinostilbene42438-89-157 % similar 4-Methoxyphenol150-76-557 % similar 4-Methoxyresveratrol33626-08-355 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Ethyl 2-furoate1335-40-6 Methyl 5-methyl-2-furancarboxylate2527-96-0 3,5-Dihydroxybenzyl alcohol29654-55-5 Rel-(3aR,6aS)-Tetrahydro-1H-cyclopenta[c]furan-1,3(3aH)-dione35878-28-5 2-Acetyl-1,3-cyclopentanedione3859-39-0 3,4-Dihydroxybenzyl alcohol3897-89-0 Ethyl maltol4940-11-8 Methyl 3-methyl-2-furancarboxylate6141-57-7

Elsewhere

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