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Isoeugenyl methyl ether

CAS 6380-24-1C11H14O2MW 178.10 g/mol

Isoeugenyl methyl ether (CAS 6380-24-1) — formula C11H14O2, molecular weight 178.10 g/mol.

Specifications

CAS Number6380-24-1
Molecular FormulaC11H14O2
Molecular Weight178.10 g/mol
Melting Point16 - 17 °C
Boiling Point270.50 °C. @ 760.00 mm Hg
LogP2.5

Purchase Profile

What this product is

Isoeugenyl methyl ether is a chemical compound with CAS registry number 6380-24-1 and molecular formula C11H14O2 (molecular weight 178.10 g/mol).

Identification

CAS number: 6380-24-1

Its molecular formula C11H14O2 comprises 11 C, 14 H, 2 O atoms.

Also known as: Isoeugenyl methyl ether · cis-Methylisoeugenol

Frequently Asked Questions

What is the CAS number of Isoeugenyl methyl ether?

The CAS registry number of Isoeugenyl methyl ether is 6380-24-1.

What is the molecular formula and molecular weight of Isoeugenyl methyl ether?

Molecular formula C11H14O2, molecular weight 178.10 g/mol.

What other names is Isoeugenyl methyl ether known by?

It is also registered under: Isoeugenyl methyl ether, cis-Methylisoeugenol.

PubChem Public Data

Public-database records for Isoeugenyl methyl ether (CAS 6380-24-1), reproduced here for independent cross-checking.

Safety classification and hazard statements

Reported hazard statementsH317, H351

H317: May cause an allergic skin reaction [Warning Sensitization, Skin]

H351: Suspected of causing cancer [Warning Carcinogenicity]

Regulatory listings

Regulatory & Food ContactFDA Substance added to food: FLAVORING AGENT OR ADJUVANT
Flavoring Agents
FLAVOURING_AGENT: Flavouring Agent
No safety concern at current levels of intake when used as a flavouring agent
TRS 922-JECFA 61/96
FAS 52-JECFA 61/389

Physical description and handling notes

  • Liquid
  • colourless to pale yellow liquid; delicate, clove-carnation aroma
  • Insoluble in glycerine and propylene glycol; soluble in most fixed oils
  • soluble (in ethanol)

Reported physical properties

沸点270.50 °C. @ 760.00 mm Hg
沸点262-264 °C
熔点16 - 17 °C
密度1.047-1.053
折射率1.566-1.569

How this substance is indexed

CAS Registry Number6380-24-1
PubChem CID1549045
分子式C11H14O2
分子量178.10 g/mol
IUPAC 名称1,2-dimethoxy-4-[(Z)-prop-1-enyl]benzene
InChIKeyNNWHUJCUHAELCL-PLNGDYQASA-N
UNII(FDA)64DPK8DS6F
ChEBI 编号CHEBI:50550
FEMA 编号2476
JECFA 编号1266

Documented uses

  • Flavoring Agents -> JECFA Flavorings Index
  • Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
  • Not Known or Reasonably Ascertainable
  • Benzene, 1,2-dimethoxy-4-(1-propen-1-yl)-: ACTIVE

Names this substance appears under

Isoeugenyl methyl ether; 1,2-dimethoxy-4-[(Z)-prop-1-enyl]benzene; Benzene, 1,2-dimethoxy-4-(1-propen-1-yl)-; 1,2-dimethoxy-4-((Z)-prop-1-enyl)benzene; RefChem:791862; 3-(3,4-Dimethoxyphenyl)-2-propene; ISOEUGENYL METHYL ETHER [FHFI]; cis-Methylisoeugenol; 6380-24-1; cis-Methyl isoeugenol; (Z)-Methylisoeugenol; (Z)-methyl isoeugenol; Methylisoeugenol, (Z)-; cis-4-Propenyl veratrole; O-Methylisoeugenol; Benzene, 1,2-dimethoxy-4-(1-propenyl)-, (Z)-

Computed molecular descriptors

分子量178.23
XLogP32.5
氢键供体数0
氢键受体数2
可旋转键数3
精确质量178.099379685
单同位素质量178.099379685
拓扑极性表面积18.5
重原子数13
形式电荷0

Database abstract

Isoeugenyl methyl ether is identified by CAS 6380-24-1, molecular formula C11H14O2 and molecular weight 178.10 g/mol. UNII 64DPK8DS6F; ChEBI 50550; InChIKey NNWHUJCUHAELCL-PLNGDYQASA-N. 沸点: 270.50 °C. @ 760.00 mm Hg; 沸点: 262-264 °C; 熔点: 16 - 17 °C.

Source: PubChem / Wikidata; the batch COA governs where values differ.

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