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Hydroxytyrosol Acetate

CAT: 0931-T8168-02Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-T8168-02Size:10 mg
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CAS Number
69039-02-7
Target
Antioxidant
Related Pathways
Oxidation-Reduction
Purity
0.9997
Bioactivity
Hydroxytyrosol Acetate (HTy-Ac) is found in the olive oil with antioxidant activity.
Smiles
CC(=O)OCCc1ccc(O)c(O)c1
Molecular Formula
C10H12O4
Molecular Weight
196.2
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Hydroxytyrosol Acetate

hydroxytyrosol acetate has been reported in Olea europaea with data available.

CAS Number69039-02-7
PubChem CID155240
IUPAC Name2-(3,4-dihydroxyphenyl)ethyl acetate
Molecular FormulaC10H12O4
Molecular Weight196.20
XLogP-0.1
Topological Polar Surface Area66.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count14
Formal Charge0
Complexity193
SMILES
CC(=O)OCCC1=CC(=C(C=C1)O)O
InChI
InChI=1S/C10H12O4/c1-7(11)14-5-4-8-2-3-9(12)10(13)6-8/h2-3,6,12-13H,4-5H2,1H3
InChIKey
FGJGLFPNIZXRLV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Hydroxytyrosol Acetate
CAS: 69039-02-7
CID: 155240
Formula: C10H12O4
MW: 196.20
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight196.20
XLogP3-0.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass196.07355886
Monoisotopic Mass196.07355886
Topological Polar Surface Area66.8 Ų
Heavy Atom Count14
Formal Charge0
Complexity193
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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