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Eugenol

CAT: 1410-M16881-01Size: 500 mgDry Ice: NoHazardous: No
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CAT#:1410-M16881-01Size:500 mg
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Description
Eugenol is a Standardized Chemical Allergen. The physiologic effect of eugenol is by means of Increased Histamine Release and Cell-mediated Immunity.
CAS Number
97-53-0
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
164.2
Molecular Formula
C10H12O2
Notes
Research use only, not for human use.
Receptor
Others

Chemical Information

Eugenol

Eugenol is a phenylpropanoid formally derived from guaiacol with an allyl chain substituted para to the hydroxy group. It is a major component of clove essential oil, and exhibits antibacterial, analgesic and antioxidant properties. It has been widely used in dentistry to treat toothache and pulpitis. It has a role as a sensitiser, a volatile oil component, an antibacterial agent, an analgesic, an antineoplastic agent, a flavouring agent, an EC 1.4.3.4 (monoamine oxidase) inhibitor, a voltage-gated sodium channel blocker, an anaesthetic, a radical scavenger, an allergen, an anti-inflammatory agent, an apoptosis inducer, a NF-kappaB inhibitor and a human blood serum metabolite. It is an alkenylbenzene, a monomethoxybenzene, a phenylpropanoid and a member of phenols. It is functionally related to a guaiacol.

CAS Number97-53-0
PubChem CID3314
IUPAC Name2-methoxy-4-prop-2-enylphenol
Molecular FormulaC10H12O2
Molecular Weight164.20
XLogP2
Topological Polar Surface Area29.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count12
Formal Charge0
Complexity145
SMILES
COC1=C(C=CC(=C1)CC=C)O
InChI
InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3
InChIKey
RRAFCDWBNXTKKO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Eugenol
CAS: 97-53-0
CID: 3314
Formula: C10H12O2
MW: 164.20
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight164.20
XLogP32
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass164.083729621
Monoisotopic Mass164.083729621
Topological Polar Surface Area29.5 Ų
Heavy Atom Count12
Formal Charge0
Complexity145
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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