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Benzene,2-bromo-4-fluoro-1-(1-methylethoxy)-

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Name

Benzene,2-bromo-4-fluoro-1-(1-methylethoxy)-

EINECS N/A
CAS No. 202865-79-0 Density 1.393 g/cm3
PSA 9.23000 LogP 3.37540
Solubility N/A Melting Point N/A
Formula C9H10BrFO Boiling Point 243.6 °C at 760 mmHg
Molecular Weight 233.08 Flash Point 123.6 °C
Transport Information N/A Appearance N/A
Safety 26-36/37/39 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 202865-79-0 (2-(2'-BROMO-4'-FLUOROPHENOXY)PROPANE) Hazard Symbols IrritantXi
Synonyms

2-Bromo-4-fluoro-1-isopropoxybenzene;5-Fluoro-2-isopropoxyphenyl bromide;

 

Benzene,2-bromo-4-fluoro-1-(1-methylethoxy)- Specification

The Benzene, 2-bromo-4-fluoro-1-(1-methylethoxy)-, with the CAS registry number 202865-79-0, is also known as 2-(2'-Bromo-4'-fluorophenoxy)propane. It belongs to the product categories of Anisoles, Alkyloxy Compounds & Phenylacetates; Bromine Compounds; Fluorine Compounds. This chemical's molecular formula is C9H10BrFO and molecular weight is 233.08. What's more, its IUPAC name is 2-Bromo-4-fluoro-1-propan-2-yloxybenzene.

Physical properties about Benzene, 2-bromo-4-fluoro-1-(1-methylethoxy)- are: (1)ACD/LogP: 3.70; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.7; (4)ACD/LogD (pH 7.4): 3.7; (5)ACD/BCF (pH 5.5): 382.34; (6)ACD/BCF (pH 7.4): 382.34; (7)ACD/KOC (pH 5.5): 2455.38; (8)ACD/KOC (pH 7.4): 2455.38; (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: 1.507; (14)Molar Refractivity: 49.83 cm3; (15)Molar Volume: 167.2 cm3; (16)Polarizability: 19.75×10-24 cm3; (17)Surface Tension: 32.2 dyne/cm; (18)Density: 1.393 g/cm3; (19)Flash Point: 123.6 °C; (20)Enthalpy of Vaporization: 46.11 kJ/mol; (21)Boiling Point: 243.6 °C at 760 mmHg; (22)Vapour Pressure: 0.0497 mmHg at 25 °C.

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. In addition, this chemical may cause inflammation to the skin or other mucous membranes. During using it, wear suitable protective clothing, gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1) SMILES: Brc1cc(F)ccc1OC(C)C
(2) InChI: InChI=1/C9H10BrFO/c1-6(2)12-9-4-3-7(11)5-8(9)10/h3-6H,1-2H3
(3) InChIKey: HFSLIMXPHXLCKX-UHFFFAOYAE

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