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4747-15-3

Basic Information
CAS No.: 4747-15-3
Name: BETA-METHOXYSTYRENE
Article Data: 31
Molecular Structure:
Molecular Structure of 4747-15-3 (BETA-METHOXYSTYRENE)
Formula: C9H10O
Molecular Weight: 134.178
Synonyms: beta-Methoxystyrene;Methyl alpha-styryl ether;2-Methoxyethenyl]benzene;Methyl 2-phenylvinyl ether;
EINECS: 225-265-1
Density: 0.981 g/cm3
Melting Point: 175 °C
Boiling Point: 209 °C at 760 mmHg
Flash Point: 77.3 °C
Hazard Symbols: Xi
Risk Codes: 43-51
Safety: 36/37
PSA: 9.23000
LogP: 2.30370
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Specification

The Benzene, (2-methoxyethenyl)-, with the CAS registry number 4747-15-3, is also known as Methyl alpha-styryl ether. It belongs to the product categories of Monomer; Enol Ethers; Organic Building Blocks; Oxygen Compounds. Its EINECS number is 225-265-1. This chemical's molecular formula is C9H10O and molecular weight is 134.18. What's more, its systematic name is (2-methoxyethenyl)benzene. Its storage temperature is 2 - 8°C. Moreover, it should be protected from oxidants and acids.

Physical properties of Benzene, (2-methoxyethenyl)- are: (1)ACD/LogP: 2.64; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.64; (4)ACD/LogD (pH 7.4): 2.64; (5)ACD/BCF (pH 5.5): 59.96; (6)ACD/BCF (pH 7.4): 59.96; (7)ACD/KOC (pH 5.5): 651.94; (8)ACD/KOC (pH 7.4): 651.94; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 9.23 Å2; (13)Index of Refraction: 1.554; (14)Molar Refractivity: 43.88 cm3; (15)Molar Volume: 136.7 cm3; (16)Polarizability: 17.39×10-24cm3; (17)Surface Tension: 33.8 dyne/cm; (18)Density: 0.981 g/cm3; (19)Flash Point: 77.3 °C; (20)Enthalpy of Vaporization: 42.71 kJ/mol; (21)Boiling Point: 209 °C at 760 mmHg; (22)Vapour Pressure: 0.3 mmHg at 25°C.

Preparation of Benzene, (2-methoxyethenyl)-: this chemical can be prepared by (2,2-dimethoxy-ethyl)-benzene at the ambient temperature. This reaction will need reagents N,N-diisopropylethylamine, trimethylsilyl triflate and solvent CH2Cl2 with the reaction time of 3 min. The yield is about 74%.

Benzene, (2-methoxyethenyl)- can be prepared by (2,2-dimethoxy-ethyl)-benzene at the ambient temperature

Uses of Benzene, (2-methoxyethenyl)-: it can be used to produce 1-methoxy-1,3-diethoxy-2-phenylbutane. It will need reagent zinc chloride and solvent ethyl acetate. The yield is about 78%.

Benzene, (2-methoxyethenyl)- can be used to produce 1-methoxy-1,3-diethoxy-2-phenylbutane

You can still convert the following datas into molecular structure:
(1)SMILES: O(C=Cc1ccccc1)C
(2)InChI: InChI=1S/C9H10O/c1-10-8-7-9-5-3-2-4-6-9/h2-8H,1H3
(3)InChIKey: CTHJQRHPNQEPAB-UHFFFAOYSA-N