chempirical

Syringyl alcohol

C9H12O4CAS 530-56-3184.19 g/mol

Open in Covalent MOL file
OOHOHO
AlcoholEtherPhenol

Properties

Molecular formula
C9H12O4
Molar mass
184.19 g/mol
Exact mass
184.0736 Da
Melting point
136 °C
logP
0.90Crippen estimate
Polar surface area
58.9 Ų
H-bond donors / acceptors
2 / 4
Rotatable bonds
3

Identifiers

CAS number
530-56-3
SMILES
COc1cc(CO)cc(OC)c1O
InChIKey
LUOAEJWSKPQLJD-UHFFFAOYSA-N
InChI
InChI=1S/C9H12O4/c1-12-7-3-6(5-10)4-8(13-2)9(7)11/h3-4,10-11H,5H2,1-2H3

Weigh it out

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

Names and synonyms

7 names
  • Benzenemethanol, 4-hydroxy-3,5-dimethoxy-
  • Benzyl alcohol, 4-hydroxy-3,5-dimethoxy-
  • 4-Hydroxy-3,5-dimethoxybenzenemethanol
  • 4-Hydroxy-3,5-dimethoxybenzyl alcohol
  • 3,5-Dimethoxy-4-hydroxybenzyl alcohol
  • 2,6-Dimethoxy-4-(hydroxymethyl)phenol
  • Syringic alcohol

Work with Syringyl alcohol

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

3,4,5-Trimethoxybenzyl alcohol3840-31-168 % similar Veratrole alcohol93-03-860 % similar Vanillyl alcohol498-00-059 % similar 4-Hydroxy-3,5-dimethoxybenzeneacetonitrile42973-55-758 % similar Methoxyeugenol6627-88-958 % similar 2,6-Dimethoxyhydroquinone15233-65-557 % similar 4-Methylsyringol6638-05-755 % similar 3,5-Dimethoxybenzenemethanol705-76-055 % similar

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

Same formula

2,4,6-Trimethoxyphenol20491-92-3 2,3-Dimethoxy-5-methyl-1,4-benzenediol3066-90-8 3,4,5-Trimethoxyphenol642-71-7

Elsewhere

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