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| CAS No.: | 23431-48-3 |
|---|---|
| Name: | ALLYL P-TOLYL ETHER |
| Article Data: | 63 |
| Molecular Structure: | |
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| Formula: | C10H12O |
| Molecular Weight: | 148.205 |
| Synonyms: | Allyltolylether; |
| Density: | 0.939 g/cm3 |
| Boiling Point: | 214.5 °C at 760 mmHg |
| Flash Point: | 79.7 °C |
| Risk Codes: | 36/37/38 |
| Safety: | 26-36/37/39 |
| PSA: | 9.23000 |
| LogP: | 2.55980 |
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Specification
The Benzene,1-methyl-4-(2-propen-1-yloxy)-, with the CAS registry number of 23431-48-3, is also known as Allyltolylether. This chemical's molecular formula is C10H12O and molecular weight is 148.2. What's more, its IUPAC name is 8-Methyl-1H-quinolin-4-one. It used as chemical reagent. In addition, it must be stored at room temperature.
Physical properties about the Benzene,1-methyl-4-(2-propen-1-yloxy)- are: (1)ACD/LogP: 3.40; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.4; (4)ACD/LogD (pH 7.4): 3.4; (5)#H bond acceptors: 1; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 3; (8)Polar Surface Area: Å2; (9)Index of Refraction: 1.504; (10)Molar Refractivity: 46.74 cm3; (11)Molar Volume: 157.8 cm3; (12)Surface Tension: 30.2 dyne/cm; (13)Density: 0.939 g/cm3; (14)Flash Point: 79.7 °C; (15)Enthalpy of Vaporization: 43.25 kJ/mol; (16)Boiling Point: 214.5 °C at 760 mmHg; (17)Vapour Pressure: 0.227 mmHg at 25 °C.
Preparation: this chemical is prepared by reaction of 3-Bromo-propene with 4-Methyl-phenol. The reaction needs reagent K2CO3 and solvent Acetone. The reaction time is 20 h with reaction temperature of 60 - 70 °C. The yield is about 59 %.
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Uses: it is used to produce other chemicals. For example, it is used to produce2-Allyl-4-methyl-phenol. This reaction needs reagents Me3Al and Water. Meanwhile, it needs solvent CH2Cl2. The reaction time is 1 h with reaction temperature of -20 °C. The yield is about 84 %.
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When you are using this chemical, please be cautious about it as the following:
As a chemical, it is irritating to eyes, respiratory system and skin. If contact with eyes accidently, rinse immediately with plenty of water and seek medical advice. Besides, during using it, wear suitable protective clothing, gloves and eye/face protection.
You can still convert the following datas into molecular structure:
(1) SMILES: Cc1ccc(cc1)OCC=C
(2) InChI: InChI=1/C10H12O/c1-3-8-11-10-6-4-9(2)5-7-10/h3-7H,1,8H2,2H3
(3) InChIKey: AROCNZZBLCAOPH-UHFFFAOYAL