W246830

Isoeugenol

natural, 99%, FG

• Synonym(s): 2-Methoxy-4-propenylphenol
• Linear Formula: CH₃OC₆H₃(CH=CHCH₃)OH
• CAS Number: 97-54-1
• Molecular Weight: 164.20
• FEMA Number: 2468
• Beilstein/REAXYS Number: 1909602
• EC Number: 202-590-7
• MDL number: MFCD00009285
• UNSPSC Code: 12164502
• PubChem Substance ID: 329830495
• Flavis number: 4.004
• NACRES: NA.21

Properties

• biological source: Betel leaf oil
• Quality Level: 400
• grade: FG; Fragrance grade; Halal; Kosher; natural
• agency: follows IFRA guidelines
• reg. compliance: EU Regulation 1223/2009; EU Regulation 1334/2008 & 178/2002; FDA 21 CFR 117
• vapor density: >1 (vs air)
• vapor pressure: <0.01 mmHg ( 20 °C)
• assay: 99%
• composition: contains IFRA and EU 1223/2009 restricted Isoeugenol
• refractive index: n20/D 1.575 (lit.)
• bp: 132 °C/10 mmHg (lit.)
• density: 1.083 g/mL at 25 °C
• application(s): flavors and fragrances
• documentation: see Safety & Documentation for available documents
• food allergen: no known allergens
• fragrance allergen: isoeugenol
• organoleptic: clove; woody; spicy; smoky; sweet
• SMILES string: OC1=CC=C(/C=C/C)C=C1OC
• InChI: 1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3-7,11H,1-2H3/b4-3+
• InChI key: BJIOGJUNALELMI-ONEGZZNKSA-N

Description

General description

Isoeugenol is an isomer of eugenol found in essential oils, soaps, wine, monsoon coffee, and various herbs and plants. It acts as a flavoring and storage agent, and has antioxidant properties. It is used to produce vanillin, essential oils, flavorings, and perfumes. It is an essential oil ingredient, recognized as GRAS (generally recognized as safe) and approved as a food flavoring agent.

Application

Isoeugenol is used as a starting material to produce vanillin through a biological process.

Safety Information

• pictograms: GHS07
• signalword: Warning
• hcodes: H302 + H312,H315,H317,H319,H335
• pcodes: P261 - P264 - P280 - P301 + P312 - P302 + P352 + P312 - P305 + P351 + P338
• Hazard Classifications: Acute Tox. 4 Dermal - Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - Skin Sens. 1A - STOT SE 3
• target_organs: Respiratory system
• Storage Class: 10 - Combustible liquids
• wgk_germany: WGK 2
• flash_point_f: 233.6 °F - closed cup
• flash_point_c: 112 °C - closed cup