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3257-51-0

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Basic Information
CAS No.: 3257-51-0
Name: 1-(4-BROMOBUTOXY)-2-METHOXY-BENZENE
Article Data: 4
Molecular Structure:
Molecular Structure of 3257-51-0 (1-(4-BROMOBUTOXY)-2-METHOXY-BENZENE)
Formula: C11H15BrO2
Molecular Weight: 259.14
Synonyms: 1-(4-BROMOBUTOXY)-2-METHOXY-BENZENE
Density: 1.294 g/cm3
Boiling Point: 316.4 °C at 760 mmHg
Flash Point: 133.1 °C
Hazard Symbols: IrritantXi
PSA: 18.46000
LogP: 3.24910
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Specification

The Benzene,1-(4-bromobutoxy)-2-methoxy- has CAS registry number 3257-51-0. This chemical's molecular formula is C11H15BrO2 and molecular weight is 259.14. What's more, its IUPAC name is 1-(4-bromobutoxy)-2-methoxybenzene. When you are using this chemical, please be cautious about it. It may cause inflammation to the skin or other mucous membranes. 

Physical properties of Benzene,1-(4-bromobutoxy)-2-methoxy- are: (1)ACD/LogP: 3.54; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.54; (4)ACD/LogD (pH 7.4): 3.54; (5)ACD/BCF (pH 5.5): 290.52; (6)ACD/BCF (pH 7.4): 290.52; (7)ACD/KOC (pH 5.5): 2017.18; (8)ACD/KOC (pH 7.4): 2017.18; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 18.46 Å2; (13)Index of Refraction: 1.524; (14)Molar Refractivity: 61.24 cm3; (15)Molar Volume: 200.1 cm3; (16)Polarizability: 24.27×10-24cm3; (17)Surface Tension: 36.5 dyne/cm; (18)Density: 1.294 g/cm3; (19)Flash Point: 133.1 °C; (20)Enthalpy of Vaporization: 53.55 kJ/mol; (21)Boiling Point: 316.4 °C at 760 mmHg; (22)Vapour Pressure: 0.000764 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: BrCCCCOc1ccccc1OC
(2)Std. InChI: InChI=1S/C11H15BrO2/c1-13-10-6-2-3-7-11(10)14-9-5-4-8-12/h2-3,6-7H,4-5,8-9H2,1H3
(3)Std. InChIKey: IBOIPLXRAWCRMO-UHFFFAOYSA-N