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3-Bromo-5-ethoxypyridine

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Name

3-Bromo-5-ethoxypyridine

EINECS N/A
CAS No. 171171-17-8 Density 1.45 g/cm3
PSA 22.12000 LogP 2.24280
Solubility N/A Melting Point N/A
Formula C7H8BrNO Boiling Point 230.214 °C at 760 mmHg
Molecular Weight 202.0485 Flash Point 93.031 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 171171-17-8 (3-Bromo-5-ethoxypyridine) Hazard Symbols N/A
Synonyms

3-BROMO-5-ETHOXYPRIDINE

 

3-Bromo-5-ethoxypyridine Specification

The 3-Bromo-5-ethoxypyridine, with the CAS registry number 171171-17-8, is also known as Pyridine, 3-bromo-5-ethoxy-. This chemical's molecular formula is C7H8BrNO and molecular weight is 202.0485. Its systematic name is 3-Bromo-5-ethoxypyridine.

Physical properties about 3-Bromo-5-ethoxypyridine are: (1)ACD/LogP: 2.41; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3; (4)ACD/LogD (pH 7.4): 3; (5)ACD/BCF (pH 5.5): 73; (6)ACD/BCF (pH 7.4): 73; (7)ACD/KOC (pH 5.5): 747; (8)ACD/KOC (pH 7.4): 748; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 22.12 Å2; (13)Index of Refraction: 1.534; (14)Molar Refractivity: 43.346 cm3; (15)Molar Volume: 139.351 cm3; (16)Polarizability: 17.184×10-24 cm3; (17)Surface Tension: 39.06 dyne/cm; (18)Density: 1.45 g/cm3; (19)Flash Point: 93.031 °C; (20)Enthalpy of Vaporization: 44.788 kJ/mol; (21)Boiling Point: 230.214 °C at 760 mmHg; (22)Vapour Pressure: 0.101 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Brc1cc(OCC)cnc1CopyCopied
(2) InChI: InChI=1/C7H8BrNO/c1-2-10-7-3-6(8)4-9-5-7/h3-5H,2H2,1H3 CopyCopied
(3) InChIKey: FYUMRYNAZSTXJV-UHFFFAOYAR

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