Identification

PhytoHub ID
PHUB001371
Name
Tyrosol
Systematic Name
Not Available
Synonyms
  • 2-(4'-Hydroxyphenyl)ethanol
  • 4-(2-Hydroxyethyl)phenol
  • 4-Hydroxyphenethyl alcohol
CAS Number
501-94-0
Average Mass
138.166
Monoisotopic Mass
138.068079562
Chemical Formula
C8H10O2
IUPAC Name
tyrosol
InChI Key
YCCILVSKPBXVIP-UHFFFAOYSA-N
InChI Identifier
InChI=1S/C8H10O2/c9-6-5-7-1-3-8(10)4-2-7/h1-4,9-10H,5-6H2
SMILES
OCCC1=CC=C(O)C=C1
Structure

Calculated Properties

Solubility (ALOGPS)
Not Available
LogS (ALOGPS)
Not Available
LogP (ALOGPS)
Not Available
Hydrogen Acceptors
2
Hydrogen Donors
2
Rotatable Bond Count
2
Polar Surface Area
40.46
Refractivity
39.6098
Polarizability
14.839197087800269
Formal Charge
0
Physiological Charge
0
pKa (strongest basic)
-2.4009234189336803
pKa (strongest acidic)
10.20403264247904
Number of Rings
1
Rule of Five
Yes
Bioavailability
Yes
Ghose Filter
No
Veber's Rule
No
MDDR-like Rule
No

Taxonomy

Family
Polyphenols
Class
Phenolic acids
Sub-class
Miscellaneous phenolic acids

Classyfire Taxonomy

Kingdom Name
Organic compounds
Class
Phenols
Super-class
Benzenoids
Sub-class
Tyrosols and derivatives
Direct Parent Name
Tyrosols
Alternative Parent Names
["1-hydroxy-2-unsubstituted benzenoids", "Benzene and substituted derivatives", "Hydrocarbon derivatives", "Primary alcohols"]
External Descriptor Annotations
["an aromatic compound", "phenols"]
Substituent Names
["1-hydroxy-2-unsubstituted benzenoid", "Alcohol", "Aromatic homomonocyclic compound", "Hydrocarbon derivative", "Monocyclic benzene moiety", "Organic oxygen compound", "Organooxygen compound", "Primary alcohol", "Tyrosol"]

Spectra

No spectra information available

Food Sources

NameGroup
BeerBeverages, AlcoholicShow
Olive oilFats and oilsShow
Olive, blackFruit, Drupes PublicationsShow
Olive, greenFruit, Drupes PublicationsShow

Metabolism

PrecursorMetaboliteSpeciesBiofluidsOriginFormulaMonoisotopic mass
Tyrosol Tyrosol 4-sulfatehumanurinehost metabolismC8H10O5S218.024894596 Publications
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