4-Bromo-2-fluoro-1-propoxybenzene supplier

Name
4-Bromo-2-fluoro-1-propoxybenzene
EINECS
CAS No. 127326-77-6
Density 1.397 g/cm³
Solubility
Melting Point
Formula C₉H₁₀BrFO
Boiling Point 251.471 °C at 760 mmHg
Molecular Weight 233.0775032
Flash Point 128.816 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Benzene, 4-bromo-2-fluoro-1-propoxy-;
PSA 9.23000
LogP 3.37700

4-Bromo-2-fluoro-1-propoxybenzene Specification

Systematic name of this chemical is 4-Bromo-2-fluoro-1-propoxybenzene and its CAS registry number is 127326-77-6. This chemical is also known as Benzene, 4-bromo-2-fluoro-1-propoxy-. It belongs to the product categories of Anisoles, Alkyloxy Compounds & Phenylacetates; Bromine Compounds; Fluorine Compounds. Its molecular formula is C₉H₁₀BrFO and molecular weight is 233.0775032.

Physical properties about the 4-Bromo-2-fluoro-1-propoxybenzene are: (1)ACD/LogP: 4.27; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4; (4)ACD/LogD (pH 7.4): 4; (5)ACD/BCF (pH 5.5): 949; (6)ACD/BCF (pH 7.4): 949; (7)ACD/KOC (pH 5.5): 4706; (8)ACD/KOC (pH 7.4): 4706; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 9.23 Å²; (13)Index of Refraction: 1.51; (14)Molar Refractivity: 49.881 cm³; (15)Molar Volume: 166.844 cm³; (16)Surface Tension: 33.413 dyne/cm; (17)Density: 1.397 g/cm³; (18)Flash Point: 128.816 °C; (19)Enthalpy of Vaporization: 46.901 kJ/mol; (20)Boiling Point: 251.471 °C at 760 mmHg; (21)Vapour Pressure: 0.032 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Brc1cc(F)c(OCCC)cc1
(2) InChI: InChI=1/C9H10BrFO/c1-2-5-12-9-4-3-7(10)6-8(9)11/h3-4,6H,2,5H2,1H3
(3) InChIKey: MHEJXUAOBZGJKW-UHFFFAOYAL

Product Name

4-Bromo-2-fluoro-1-propoxybenzene

4-Bromo-2-fluoro-1-propoxybenzene Specification

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