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Cas Database |
| Name |
METHYL-3-METHOXY-4-HYDROXY STYRYL KETONE |
EINECS | N/A |
| CAS No. | 1080-12-2 | Density | 1.154g/cm3 |
| PSA | 46.53000 | LogP | 2.00300 |
| Solubility | N/A | Melting Point |
125-130oC |
| Formula | C11H12 O3 | Boiling Point | 348.2oC at 760 mmHg |
| Molecular Weight | 192.214 | Flash Point | 136.9oC |
| Transport Information | N/A | Appearance | N/A |
| Safety | Moderately toxic by intraperitoneal route. Slightly toxic by ingestion. A flammable liquid. When heated to decomposition it emits acrid smoke and irritating vapors. | Risk Codes | 36/37/38 |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
3-Methoxy-4-hydroxybenzalacetone;4-(4-Hydroxy-3-methoxyphenyl)-3-buten-2-one;4-Hydroxy-3-methoxybenzylideneacetone; 4-Hydroxy-3-methoxystyryl methyl ketone;Dehydro[0]-paradol; Dehydrogingerone; Dehydrozingerone; Feruloylmethane; NSC26613; NSC 4019; NSC 44708; NSC 45411; NSC 5316; Vanillalacetone; [0]-Paradol,dehydro- |
Article Data | 108 |
METHYL-3-METHOXY-4-HYDROXY STYRYL KETONE Synthetic route
| Conditions | Yield |
|---|---|
| With sodium hydroxide In water; acetone at 10 - 20℃; | 95% |
| With sodium hydroxide In acetone at 20℃; for 12h; |
| Conditions | Yield |
|---|---|
| With potassium hydroxide In methanol; water for 0.00833333h; Claisen Condensation; Microwave irradiation; | 92% |
| With sodium hydroxide for 0.25h; Irradiation; | 88% |
| With sodium hydroxide In ethanol; water at 20℃; | 87% |
- 121-33-5
vanillin
- 106-96-7
propargyl bromide
A
- 1080-12-2
Dehydrozingerone
B
- 132927-15-2
4-(1-hydroxybut-3-ynyl)-2-methoxyphenol
| Conditions | Yield |
|---|---|
| With tin In tetrahydrofuran; water; hydrogen bromide for 2h; Ambient temperature; Yield given. Yields of byproduct given; | |
| With tin; hydrogen bromide In tetrahydrofuran for 2h; Ambient temperature; Yield given. Yields of byproduct given; |
| Conditions | Yield |
|---|---|
| With boron trifluoride diethyl etherate In dichloromethane |
- 1080-12-2
Dehydrozingerone
| Conditions | Yield |
|---|---|
| With emulsin |
- 61152-59-8
4-(4-hydroxyphenyl-3-methoxy)-4-hydroxy-2-butanone
- 1080-12-2
Dehydrozingerone
| Conditions | Yield |
|---|---|
| With hydrogenchloride at 20℃; |
| Conditions | Yield |
|---|---|
| Multi-step reaction with 2 steps 1: aq. NaOH / 20 °C 2: aq. HCl / 20 °C View Scheme |
| Conditions | Yield |
|---|---|
| With eugenol oxidase from Rhodococcus jostii RHA1 In dimethyl sulfoxide at 20℃; for 12h; pH=8; Enzymatic reaction; |
METHYL-3-METHOXY-4-HYDROXY STYRYL KETONE Chemical Properties
Product Name: Methyl-3-methoxy-4-hydroxy styryl ketone (CAS NO.1080-12-2)
Molecular Formula: C11H12O3
Molecular Weight: 192.21g/mol
Mol File: 1080-12-2.mol
Einecs: 214-096-9
Melting Point: 125-130 °C
Boiling point: 348.2 °C at 760 mmHg
Flash Point: 136.9 °C
Density: 1.154 g/cm3
Surface Tension: 43.1 dyne/cm
Enthalpy of Vaporization: 61.59 kJ/mol
Vapour Pressure: 2.55E-05 mmHg at 25°C
XLogP3: 1.7
H-Bond Donor: 1
H-Bond Acceptor: 3
Product Categories: Aromatic Ketones (substituted)
METHYL-3-METHOXY-4-HYDROXY STYRYL KETONE Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | intraperitoneal | 610mg/kg (610mg/kg) | Arzneimittel-Forschung. Drug Research. Vol. 37, Pg. 708, 1987. | |
| mouse | LDLo | oral | > 2gm/kg (2000mg/kg) | Arzneimittel-Forschung. Drug Research. Vol. 37, Pg. 708, 1987. | |
| rat | LD | oral | > 1gm/kg (1000mg/kg) | Indian Journal of Pharmaceutical Sciences. Vol. 43, Pg. 226, 1981. |
METHYL-3-METHOXY-4-HYDROXY STYRYL KETONE Consensus Reports
Reported in EPA TSCA Inventory.
METHYL-3-METHOXY-4-HYDROXY STYRYL KETONE Safety Profile
Moderately toxic by intraperitoneal route. Slightly toxic by ingestion. A flammable liquid. When heated to decomposition it emits acrid smoke and irritating vapors.
Safety Information of Methyl-3-methoxy-4-hydroxy styryl ketone (CAS NO.1080-12-2):
Risk Statements: 36/37/38
36: Irritating to the eyes
37: Irritating to the respiratory system
38: Irritating to the skin
Safety Statements: 26-36/37/39
26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
36: Wear suitable protective clothing
37: Wear suitable gloves
39: Wear eye/face protection
METHYL-3-METHOXY-4-HYDROXY STYRYL KETONE Standards and Recommendations
DOT Classification: 3; Label: Flammable Liquid
METHYL-3-METHOXY-4-HYDROXY STYRYL KETONE Specification
Methyl-3-methoxy-4-hydroxy styryl ketone ,its CAS NO. is 1080-12-2,the synonyms is Vanillylidenacetone ; Vanillylideneacetone ; Vanillylidine acetone ; 4-(4-Hydroxy-3-methoxyphenyl)-3-buten-2-one ; 4-(4-Hydroxy-3-methoxyphenyl)-3-butene-2-one ; 4-(4-Hydroxy-3-methoxyphenyl)but-3-en-2-one ; Fema 3738 ; Dehydrozingerone .
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