CAS No.54815-13-3,1,1-diethoxynonane Suppliers

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Basic Information

Molecular Structure:
CAS No.:	54815-13-3
Name:	1,1-diethoxynonane
Article Data:	15

Formula:	C₁₃H₂₈O₂
Molecular Weight:	216.364
Synonyms:	Nonanal,diethyl acetal (6CI,7CI);1,1-Diethoxynonane;Nonanal diethyl acetal;
EINECS:	259-360-4
Density:	0.844 g/cm³
Boiling Point:	242.2 °C at 760 mmHg
Flash Point:	63.1 °C
PSA:	18.46000
LogP:	4.13610

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Specification

The CAS register number of Nonanal diethyl acetal is 54815-13-3. It also can be called as Nonane, 1,1-diethoxy- and the IUPAC name about this chemical is 1,1-diethoxynonane. The molecular formula about this chemical is C₁₃H₂₈O₂and the molecular weight is 216.36.

Physical properties about Nonanal diethyl acetal are: (1)ACD/LogP: 4.86; (2)ACD/LogD (pH 5.5): 4.86; (3)ACD/LogD (pH 7.4): 4.86; (4)ACD/BCF (pH 5.5): 2930.02; (5)ACD/BCF (pH 7.4): 2930.02; (6)ACD/KOC (pH 5.5): 10548.27; (7)ACD/KOC (pH 7.4): 10548.27; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 11; (10)Polar Surface Area: 18.46Å²; (11)Index of Refraction: 1.426; (12)Molar Refractivity: 65.72 cm³; (13)Molar Volume: 256.2 cm³; (14)Polarizability: 26.05x10^-24cm³; (15)Surface Tension: 27.3 dyne/cm; (16)Enthalpy of Vaporization: 45.98 kJ/mol; (17)Boiling Point: 242.2 °C at 760 mmHg; (18)Vapour Pressure: 0.0534 mmHg at 25°C.

Preparation: this chemical can be prepared by nonanal and antimonous acid triethyl ester. This reaction will need reagent allyl bromide. The reaction time is 2 hour(s) with reaction temperature of 80 ℃. The yield is about 97%.

Uses of Nonanal diethyl acetal: it can be used to produce 2-heptyl-3-dimethylaminoacrolein. The yield is about 82%.

You can still convert the following datas into molecular structure:
(1)SMILES: O(CC)C(OCC)CCCCCCCC
(2)InChI: InChI=1/C13H28O2/c1-4-7-8-9-10-11-12-13(14-5-2)15-6-3/h13H,4-12H2,1-3H3
(3)InChIKey: RJMSGTVQHHFVLK-UHFFFAOYAC
(4)Std. InChI: InChI=1S/C13H28O2/c1-4-7-8-9-10-11-12-13(14-5-2)15-6-3/h13H,4-12H2,1-3H3
(5)Std. InChIKey: RJMSGTVQHHFVLK-UHFFFAOYSA-N