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| CAS No.: | 6627-88-9 |
|---|---|
| Name: | 4-ALLYL-2,6-DIMETHOXYPHENOL |
| Article Data: | 39 |
| Molecular Structure: | |
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| Formula: | C11H14O3 |
| Molecular Weight: | 194.23 |
| Synonyms: | Chavicol,2,6-dimethoxy- (6CI);Phenol, 2,6-dimethoxy-4-(2-propenyl)- (9CI);Phenol,4-allyl-2,6-dimethoxy- (7CI,8CI);2,6-Dimethoxy-4-(2-propenyl)phenol;2,6-Dimethoxy-4-allylphenol;2,6-Dimethoxychavicol;4-(2-Propenyl)syringol;4-Allyl-2,6-dimethoxyphenol;4-Allylsyringol;4-Hydroxy-3,5-dimethoxyallylbenzene;6-Methoxyeugenol;Methoxyeugenol;NSC16953;NSC 60246; |
| EINECS: | 229-600-2 |
| Density: | 1.077 g/cm3 |
| Boiling Point: | 301.4 °C at 760 mmHg |
| Flash Point: | 136.1 °C |
| Solubility: | Soluble in fats. Insoluble in water. |
| Appearance: | clear yellow to orange liquid |
| Hazard Symbols: |
 Xi
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| Risk Codes: | 36/37/38-43 |
| Safety: | 26-37/39-36/37 |
| PSA: | 38.69000 |
| LogP: | 2.13790 |
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- Total:33 Page 1 of 1 1
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Specification
The Phenol,2,6-dimethoxy-4-(2-propen-1-yl)-, with the CAS registry number 6627-88-9, is also known as 4-Hydroxy-3,5-dimethoxyallylbenzene. It belongs to the product categories of Aromatic Phenols; Organic Building Blocks; Oxygen Compounds; Phenols; A-B; Alphabetical Listings; Flavors and Fragrances. Its EINECS registry number is 229-600-2. This chemical's molecular formula is C11H14O3 and molecular weight is 194.23. Its IUPAC name is called 2,6-dimethoxy-4-prop-2-enylphenol. This chemical is clear yellow to orange liquid.
Physical properties of Phenol,2,6-dimethoxy-4-(2-propen-1-yl)-: (1)ACD/LogP: 1.79; (2)#H bond acceptors: 3; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 5; (5)Index of Refraction: 1.526; (6)Molar Refractivity: 55.39 cm3; (7)Molar Volume: 180.2 cm3; (8)Surface Tension: 35.8 dyne/cm; (9)Density: 1.077 g/cm3; (10)Flash Point: 136.1 °C; (11)Enthalpy of Vaporization: 56.32 kJ/mol; (12)Boiling Point: 301.4 °C at 760 mmHg; (13)Vapour Pressure: 0.00059 mmHg at 25°C.
Preparation: this chemical can be prepared by 2-allyloxy-1,3-dimethoxy-benzene. This reaction is a kind of Claisen rearrangement. The reaction time is 2 weeks with reaction temperature of 150 °C. The yield is about 100%.
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Uses of Phenol,2,6-dimethoxy-4-(2-propen-1-yl)-: it can be used to produce 2,6-Dimethoxy-4-propyl-phenol. This reaction will need reagent ethanol and palladium/charcoal.
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When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: COC1=CC(=CC(=C1O)OC)CC=C
(2)InChI: InChI=1S/C11H14O3/c1-4-5-8-6-9(13-2)11(12)10(7-8)14-3/h4,6-7,12H,1,5H2,2-3H3
(3)InChIKey: FWMPKHMKIJDEMJ-UHFFFAOYSA-N