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CAS No.: | 203176-36-7 |
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Name: | (E)-1-(2-Bromovinyl)-2-methoxybenzene |
Article Data: | 9 |
Molecular Structure: | |
Formula: | C9H9BrO |
Molecular Weight: | 213.074 |
Synonyms: | 1-[(E)-2-Bromovinyl]-2-methoxy-benzene; |
Density: | 1.41 g/cm3 |
Boiling Point: | 267.4 °C at 760 mmHg |
Flash Point: | 105.9 °C |
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The (E)-1-(2-Bromovinyl)-2-methoxybenzene has CAS registry number 203176-36-7. This chemical's molecular formula is C9H9BrO and molecular weight is 213.0712. What's more, its systematic name is 1-[(E)-2-Bromovinyl]-2-methoxy-benzene.
Physical properties about (E)-1-(2-Bromovinyl)-2-methoxybenzene are: (1)ACD/LogP: 2.99; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.99; (4)ACD/LogD (pH 7.4): 2.99; (5)#H bond acceptors: 1; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 2; (8)Index of Refraction: 1.603; (9)Molar Refractivity: 51.91 cm3; (10)Molar Volume: 151 cm3; (11)Polarizability: 20.58×10-24 cm3; (12)Surface Tension: 39.7 dyne/cm; (13)Density: 1.41 g/cm3; (14)Flash Point: 105.9 °C; (15)Enthalpy of Vaporization: 48.5 kJ/mol; (16)Boiling Point: 267.4 °C at 760 mmHg; (17)Vapour Pressure: 0.0135 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: COc1ccccc1/C=C/Br
(2) InChI: InChI=1/C9H9BrO/c1-11-9-5-3-2-4-8(9)6-7-10/h2-7H,1H3/b7-6+
(3) InChIKey: QVLGTXPQVOQRLD-VOTSOKGWBH