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Isoeugenyl acetate - ≥98%,FCC, high purity , CAS No.93-29-8

FCC

≥98%

CAS#: 93-29-8
Formula: C₁₂H₁₄O₃
Molecular Weight: 206.24
MDL number: MFCD00026984
PubChem CID: 876160

Item Number

I109778

Grouped product items
SKU	Size	Availability	Price
I109778-25g	25g	In stock	$9.90
I109778-50g	50g	In stock	$12.90
I109778-100g	100g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$19.90
I109778-250g	250g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$37.90

View related series

Aromatic polyketide Phenylpropanoids

Basic Description

Synonyms	A00615 \| acetyl iso eugenol \| DTXSID601020590 \| Isoeugenylacetate \| 1-(3-methoxy-4-acetoxyphenyl)-1-propene \| O-Acetylisoeugenol \| Phenol, 2-methoxy-4-(1-propen-1-yl)-, 1-acetate \| W-109345 \| isoeugenyl acetate 1 \| Phenol, 2-methoxy-4-(1E)-1-propenyl-, ac
Specifications & Purity	FCC, ≥98%
Storage Temp	Store at -20°C
Shipped In	Ice chest + Ice pads
Grade	FCC

Associated Targets(Human)

PTH1R Tclin Parathyroid hormone receptor (47172 Activities)

Discover Target: PTH1R

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

PLK1 Tchem Serine/threonine-protein kinase PLK1 (28605 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

PIN1 Tchem Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 (36611 Activities)

Discover Target: PIN1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

POLI Tchem DNA polymerase iota (116820 Activities)

Discover Target: POLI

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Names and Identifiers

IUPAC Name	[2-methoxy-4-[(E)-prop-1-enyl]phenyl] acetate
INCHI	InChI=1S/C12H14O3/c1-4-5-10-6-7-11(15-9(2)13)12(8-10)14-3/h4-8H,1-3H3/b5-4+
InChi Key	IUSBVFZKQJGVEP-SNAWJCMRSA-N
Canonical SMILES	CC=CC1=CC(=C(C=C1)OC(=O)C)OC
Isomeric SMILES	C/C=C/C1=CC(=C(C=C1)OC(=O)C)OC
PubChem CID	876160
Molecular Weight	206.24
Reaxy-Rn	2052335

Certificates

Certificate of Analysis(COA)

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6 results found

Lot Number	Certificate Type	Date	Item
B2224143	Certificate of Analysis	Nov 20, 2023	I109778
F2130289	Certificate of Analysis	Apr 12, 2023	I109778
F2130290	Certificate of Analysis	Apr 12, 2023	I109778
G2320159	Certificate of Analysis	Apr 12, 2023	I109778
C2025156	Certificate of Analysis	Jan 19, 2022	I109778
G2320177	Certificate of Analysis	Jan 19, 2022	I109778

Solubility

Soluble in Methanol

Sensitivity

Moisture sensitive.

Boil Point(°C)

283°C

Melt Point(°C)

81°C

Safety and Hazards(GHS)

Pictogram(s)	GHS07
Hazard Statements	H315:Causes skin irritation H319:Causes serious eye irritation H335:May cause respiratory irritation
Precautionary Statements	P261:Avoid breathing dust/fume/gas/mist/vapors/spray. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses if present and easy to do - continue rinsing.
Reaxy-Rn	2052335

References

1. R ten Have,R G De Thouars,H J Swarts,J A Field. (1999-10-16) Veratryl alcohol-mediated oxidation of isoeugenyl acetate by lignin peroxidase.. European journal of biochemistry, 265 ((3)): (1008-1014). [PMID:10518796]
2. I R White,J D Johansen,E G Arnau,J P Lepoittevin,S Rastogi,M Bruze,K E Andersen,P J Frosch,A Goossens,T Menné. (1999-12-20) Isoeugenol is an important contact allergen: can it be safely replaced with isoeugenyl acetate?. Contact dermatitis, 41 ((5)): (272-275). [PMID:10554062]
3. J Middleton. (2000-04-06) Fragrance allergen substitution.. Contact dermatitis, 42 ((4)): (249-249). [PMID:10750869]
4. Luca Nicolotti,Chiara Cordero,Davide Bressanello,Cecilia Cagliero,Erica Liberto,Federico Magagna,Patrizia Rubiolo,Barbara Sgorbini,Carlo Bicchi. (2014-08-19) Parallel dual secondary column-dual detection: a further way of enhancing the informative potential of two-dimensional comprehensive gas chromatography.. Journal of chromatography. A, 1360 (264-274). [PMID:25130094]
5. S Tanaka,C Royds,D Buckley,D A Basketter,A Goossens,M Bruze,C Svedman,T Menné,J D Johansen,I R White,J P McFadden. (2004-12-21) Contact allergy to isoeugenol and its derivatives: problems with allergen substitution.. Contact dermatitis, 51 ((5-6)): (288-291). [PMID:15606655]
6. Suresh Chandra Rastogi,Jeanne Duus Johansen. (2008-04-18) Significant exposures to isoeugenol derivatives in perfumes.. Contact dermatitis, 58 ((5)): (278-281). [PMID:18416757]

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