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| CAS No.: | 173336-76-0 |
|---|---|
| Name: | 4-Bromo-1-methoxy-2-(3-methoxy-propoxy)-benzene |
| Article Data: | 16 |
| Molecular Structure: | |
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| Formula: | C11H15BrO3 |
| Molecular Weight: | 275.142 |
| Synonyms: | 4-Bromo-1-methoxy-2-(3-methoxypropoxy)benzene; benzene, 4-bromo-1-methoxy-2-(3-methoxypropoxy)- |
| EINECS: | 605-674-5 |
| Density: | 1.313 g/cm3 |
| Melting Point: | 39℃ |
| Boiling Point: | 308.847 °C at 760 mmHg |
| Flash Point: | 124.378 °C |
| PSA: | 27.69000 |
| LogP: | 2.87300 |
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Specification
The 4-Bromo-1-methoxy-2-(3-methoxy-propoxy)-benzene is an organic compound with the formula C11H15BrO3. The systematic name of this chemical is 4-Bromo-1-methoxy-2-(3-methoxypropoxy)benzene. With the CAS registry number 173336-76-0, it is also named as 3-(5-Bromo-2-methoxyphenoxy)-1-methoxypropane. Besides, its molecular weight is 275.139.
Physical properties about 4-Bromo-1-methoxy-2-(3-methoxy-propoxy)-benzene are: (1)ACD/LogP: 3.14; (2)ACD/LogD (pH 5.5): 3.14; (3)ACD/LogD (pH 7.4): 3.14; (4)ACD/BCF (pH 5.5): 143.43; (5)ACD/BCF (pH 7.4): 143.43; (6)ACD/KOC (pH 5.5): 1217.11; (7)ACD/KOC (pH 7.4): 1217.11; (8)#H bond acceptors: 3; (9)#Freely Rotating Bonds: 6; (10)Polar Surface Area: 27.69 Å2; (11)Index of Refraction: 1.512; (12)Molar Refractivity: 62.94 cm3; (13)Molar Volume: 209.5 cm3; (14)Polarizability: 24.95×10-24 cm3; (15)Surface Tension: 35.1 dyne/cm; (16)Density: 1.313 g/cm3; (17)Flash Point: 124.4 °C; (18)Enthalpy of Vaporization: 52.76 kJ/mol; (19)Boiling Point: 308.8 °C at 760 mmHg; (20)Vapour Pressure: 0.00121 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C11H15BrO3/c1-13-6-3-7-15-11-8-9(12)4-5-10(11)14-2/h4-5,8H,3,6-7H2,1-2H3
(2)InChIKey: JFSCCLJKKCRXSS-UHFFFAOYAL
(3)Std. InChI: InChI=1S/C11H15BrO3/c1-13-6-3-7-15-11-8-9(12)4-5-10(11)14-2/h4-5,8H,3,6-7H2,1-2H3
(4)Std. InChIKey: JFSCCLJKKCRXSS-UHFFFAOYSA-N