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Pyridine, 2,4-diethoxy-

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Name

Pyridine, 2,4-diethoxy-

EINECS N/A
CAS No. 52311-30-5 Density 1.021 g/cm3
PSA 31.35000 LogP 1.87900
Solubility N/A Melting Point N/A
Formula C9H13NO2 Boiling Point 239.4 °C at 760 mmHg
Molecular Weight 167.208 Flash Point 87.3 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 52311-30-5 (2,4-DIETHOXYPYRIDINE) Hazard Symbols N/A
Synonyms

2,4-Diethoxypyridine;

 

Pyridine, 2,4-diethoxy- Specification

The CAS registry number of Pyridine, 2,4-diethoxy- is 52311-30-5. This chemical's molecular formula is C9H13NO2 and molecular weight is 167.21. What's more, its systematic name is called 2,4-Diethoxypyridine.

Physical properties about Pyridine, 2,4-diethoxy- are: (1) ACD/LogP: 2.90; (2) # of Rule of 5 Violations: 0; (3) ACD/LogD (pH 5.5): 2; (4) ACD/LogD (pH 7.4): 3; (5) ACD/BCF (pH 5.5): 30; (6) ACD/BCF (pH 7.4): 50; (7) ACD/KOC (pH 5.5): 340; (8) ACD/KOC (pH 7.4): 569; (9) #H bond acceptors: 3; (10) #H bond donors: 0; (11) #Freely Rotating Bonds: 4; (12) Polar Surface Area: 31.35 Å2; (13) Index of Refraction: 1.486; (14) Molar Refractivity: 46.967 cm3; (15) Molar Volume: 163.675 cm3; (16) Surface Tension: 33.691 dyne/cm; (17) Density: 1.022 g/cm3; (18) Flash Point: 87.332 °C; (19) Enthalpy of Vaporization: 45.697 kJ/mol; (20) Boiling Point: 239.395 °C at 760 mmHg; (21) Vapour Pressure: 0.062 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: CCOc1cc(ccn1)OCC
(2) InChI: InChI=1/C9H13NO2/c1-3-11-8-5-6-10-9(7-8)12-4-2/h5-7H,3-4H2,1-2H3
(3) InChIKey: NULQHNTZEYOBBS-UHFFFAOYAV

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