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Benzaldehyde,4-[2-(5-ethyl-2-pyridinyl)ethoxy]- (114393-97-4)

Identification
Name:Benzaldehyde,4-[2-(5-ethyl-2-pyridinyl)ethoxy]-
Synonyms:4-[2-(5-Ethyl-2-pyridinyl)ethoxy]benzaldehyde;4-[2-(5-Ethyl-3-pyridyl)ethoxy]benzaldehyde;
CAS:114393-97-4
Molecular Formula: C16H17NO2
Molecular Weight: 255.31
InChI: InChI=1/C16H17NO2/c1-2-13-3-6-15(17-11-13)9-10-19-16-7-4-14(12-18)5-8-16/h3-8,11-12H,2,9-10H2,1H3
Molecular Structure: (C16H17NO2) 4-[2-(5-Ethyl-2-pyridinyl)ethoxy]benzaldehyde;4-[2-(5-Ethyl-3-pyridyl)ethoxy]benzaldehyde;
Properties
Density:1.118 g/cm3
Refractive index:1.584
Appearance:Off-white low melting solid
Specification:

The cas register number of 4-[2-(5-Ethyl-2-pyridinyl)ethoxy]benzyaldehyde is 114393-97-4. It also can be called as Benzaldehyde,4-[2-(5-ethyl-2-pyridinyl)ethoxy]- and the Systematic name about this chemical is 4-[2-(5-ethylpyridin-2-yl)ethoxy]benzaldehyde.

Physical properties about 4-[2-(5-Ethyl-2-pyridinyl)ethoxy]benzyaldehyde are: (1)ACD/LogP: 3.41; (2)ACD/LogD (pH 5.5): 3; (3)ACD/LogD (pH 7.4): 3; (4)ACD/BCF (pH 5.5): 69; (5)ACD/BCF (pH 7.4): 127; (6)ACD/KOC (pH 5.5): 600; (7)ACD/KOC (pH 7.4): 1115; (8)#H bond acceptors: 3 ; (9)#Freely Rotating Bonds: 6; (10)Polar Surface Area: 39.19 Å2; (11)Index of Refraction: 1.584; (12)Molar Refractivity: 76.445 cm3; (13)Molar Volume: 228.351 cm3; (14)Polarizability: 30.305x10-24cm3; (15)Surface Tension: 45.074 dyne/cm; (16)Enthalpy of Vaporization: 68.751 kJ/mol.

You can still convert the following datas into molecular structure:
(1)SMILES: O=Cc2ccc(OCCc1ncc(cc1)CC)cc2
(2)InChI: InChI=1/C16H17NO2/c1-2-13-3-6-15(17-11-13)9-10-19-16-7-4-14(12-18)5-8-16/h3-8,11-12H,2,9-10H2,1H3
(3)InChIKey: NTSWGSRJHHXHBB-UHFFFAOYAB
(4)Std. InChI: InChI=1S/C16H17NO2/c1-2-13-3-6-15(17-11-13)9-10-19-16-7-4-14(12-18)5-8-16/h3-8,11-12H,2,9-10H2,1H3
(5)Std. InChIKey: NTSWGSRJHHXHBB-UHFFFAOYSA-N

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