CAS Number93-29-8
Synonyms2-Methoxy-4-[(1E)-1-propenyl]phenyl acetate; EINECS 202-236-1; 2-Methoxy-4-[(1E)-prop-1-en-1-yl]phenyl acetate; Phenol, 2-methoxy-4-[(1E)-1-propen-1-yl]-, acetate; MFCD00026984; 2-Methoxy-4-[(1E)-1-propen-1-yl]phenylacetat; 2-Methoxy-4-[(1E)-1-propen-1-yl]phenyl acetate; Acétate de 2-méthoxy-4-[(1E)-1-propèn-1-yl]phényle; 1-acetoxy-2-methoxy-4-(1-propenyl)benzene
Molecular FormulaC12H14O3
Molecular Weight206.24
Purity≥97.0 (GC)%
Density1.1±0.1 g/cm3
Boiling Point283.0±20.0 °C at 760 mmHg
Melting Point79-81 °C (lit.)
EINECS202-236-1
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 93-29-8 |
| Catalog No. | 2A-9017803 |
| Chinese Name | 乙酰基异丁香酚 |
| Synonyms | 2-Methoxy-4-[(1E)-1-propenyl]phenyl acetate; EINECS 202-236-1; 2-Methoxy-4-[(1E)-prop-1-en-1-yl]phenyl acetate; Phenol, 2-methoxy-4-[(1E)-1-propen-1-yl]-, acetate; MFCD00026984; 2-Methoxy-4-[(1E)-1-propen-1-yl]phenylacetat; 2-Methoxy-4-[(1E)-1-propen-1-yl]phenyl acetate; Acétate de 2-méthoxy-4-[(1E)-1-propèn-1-yl]phényle; 1-acetoxy-2-methoxy-4-(1-propenyl)benzene |
| Molecular Formula | C12H14O3 |
| Molecular Weight | 206.24 |
| Purity | ≥97.0 (GC) |
| Density | 1.1±0.1 g/cm3 |
| Boiling Point | 283.0±20.0 °C at 760 mmHg |
| Melting Point | 79-81 °C (lit.) |
| Storage Condition | This product should be stored in a sealed, cool, d |
| Application | Isoeugenol acetate, an essential oil component of nutmeg, clove and cinnamon, has good inhibitory effects on certain metabolic enzymes such as acetylcholinesterase (AChE) enzyme (IC50=77 nM; Ki=16 nM) |
| EINECS | 202-236-1 |
| PubChem ID | 329748334 |
| MDL Number | MFCD00026984 |
| SMILES | COc1cc(\C=C\C)ccc1OC(C)=O |
| 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 |
| NACRES Code | NA.24 |
| UNSPSC | 85151701 |
| Hazard Symbols | Transport |
| MSDS | msds/17803_1_93_29_8.pdf |
| Bioactivity | Isoeugenol acetate, an essential oil constituent of nutmeg, clove, and cinnamon, shows excellent inhibitory effects against some metabolic enzymes such as acetylcholinesterase (AChE) enzymes (IC50=77 nM; Ki=16 nM), α-glycosidase (IC50=19.25 nM; Ki=21 nM), and α-amylase (IC50=411.5 nM). Isoeugenol acetate is used medical and cosmetics industries for its antioxidant, anticancer, antimicrobial and anti-inflammatory properties[1][2]. Related Catalog Research Areas >> Cancer Research Areas >> Inflammation/Immunology Signaling Pathways >> Neuronal Signaling >> AChE Target IC50: 77 nM (AChE), 19.25 nM (α-glycosidase), 411.5 nM (α-amylase)[1] Ki: 16 nM (AChE), 21 nM (α-glycosidase)[1] References [1]. Fevzi Topal.Anticholinergic and antidiabetic effects of isoeugenol from clove (Eugenia caryophylata) oil. International Journal of Food Properties, 22:1,583-592. [2]. Hyldgaard M, et al. Isoeugenol has a non-disruptive detergent-like mechanism of action. Front Microbiol. 2015 Jul 28;6:754. Chemical & Physical Properties Density 1.1±0.1 g/cm3 Boiling Point 283.0±20.0 °C at 760 mmHg Melting Point 79-81 °C(lit.) Molecular Formula C12H14O3 Molecular Weight 206.238 Flash Point 113.9±16.4 °C Exact Mass 206.094299 PSA 35.53000 LogP 2.54 Vapour Pressure 0.0±0.6 mmHg at 25°C Index of Refraction 1.539 |
| Use of | Isoeugenol acetate, an essential oil constituent of nutmeg, clove, and cinnamon, shows excellent inhibitory effects against some metabolic enzymes such as acetylcholinesterase (AChE) enzymes (IC50=77 nM; Ki=16 nM), α-glycosidase (IC50=19.25 nM; Ki=21 nM), and α-amylase (IC50=411.5 nM). Isoeugenol acetate is used medical and cosmetics industries for its antioxidant, anticancer, antimicrobial and anti-inflammatory properties[1][2]. Properties Name 1-Acetoxy-2-methoxy-4-(1-propenyl)benzene Synonym More Synonyms Acetylisoeugenol Biological Activity Description Isoeugenol acetate, an essential oil constituent of nutmeg, clove, and cinnamon, shows excellent inhibitory effects against some metabolic enzymes such as acetylcholinesterase (AChE) enzymes (IC50=77 nM; Ki=16 nM), α-glycosidase (IC50=19.25 nM; Ki=21 nM), and α-amylase (IC50=411.5 nM). Isoeugenol acetate is used medical and cosmetics industries for its antioxidant, anticancer, antimicrobial and anti-inflammatory properties[1][2]. Related Catalog Research Areas >> Cancer Research Areas >> Inflammation/Immunology Signaling Pathways >> Neuronal Signaling >> AChE IC50: 77 nM (AChE), 19.25 nM (α-glycosidase), 411.5 nM (α-amylase)[1] Ki: 16 nM (AChE), 21 nM (α-glycosidase)[1] References [1]. Fevzi Topal.Anticholinergic and antidiabetic effects of isoeugenol from clove (Eugenia caryophylata) oil. International Journal of Food Properties, 22:1,583-592. [2]. Hyldgaard M, et al. Isoeugenol has a non-disruptive detergent-like mechanism of action. Front Microbiol. 2015 Jul 28;6:754. Chemical & Physical Properties Molecular Formula C12H14O3 Exact Mass 206.094299 PSA 35.53000 Index of Refraction 1.539 |
| Transport Info | Shipping Name: UN |
| MSDS Transport Info | Module 14. Shipping information 14.1 UN dangerous goods number European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.2 United Nations shipping name European Land Transport Dangerous Regulations: Non-dangerous goods IMDG Code: Non-dangerous goods International air transport dangerous goods regulations: non-dangerous goods 14.3 Transport hazard categories European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.4 Package group European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.5 Environmental hazards European Land Transport Danger Regulations: No International Maritime Danger Regulations International Air Transport Danger Regulations: No Marine pollutants (yes/no): No 14.6 Special reminder to users No data available |
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| N-(2-Methoxyphenyl)acetamide | 93-26-5 | 2A-9017801 |
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| (3,4-Dimethoxyphenyl)acetic acid | 93-40-3 | 2A-9017805 |
| 2-Mercapto-N-(2-naphthyl)acetamide | 93-42-5 | 2A-9017806 |
| 2-Naphthyl benzoate | 93-44-7 | 2A-9017807 |
| 2,5-Dimethylbenzylamine | 93-48-1 | 2A-9017809 |
| 2-Methoxy-4-methylphenol | 93-51-6 | 2A-9017810 |
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