Name: 2-(2'-BROMO-4'-FLUOROPHENOXY)PROPANE
SKU: 202865-79-0

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Basic Information

Molecular Structure:
CAS No.:	202865-79-0
Name:	2-(2'-BROMO-4'-FLUOROPHENOXY)PROPANE

Formula:	C₉H₁₀BrFO
Molecular Weight:	233.08
Synonyms:	2-Bromo-4-fluoro-1-isopropoxybenzene;5-Fluoro-2-isopropoxyphenyl bromide;
Density:	1.393 g/cm³
Boiling Point:	243.6 °C at 760 mmHg
Flash Point:	123.6 °C
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	26-36/37/39
PSA:	9.23000
LogP:	3.37540

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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