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Benzoic acid,3,4-bis(2-methoxyethoxy)-, ethyl ester (183322-16-9)

Identification
Name:Benzoic acid,3,4-bis(2-methoxyethoxy)-, ethyl ester
Synonyms:3,4-Bis(2-methoxyethoxy)benzoic acid ethyl ester;
CAS:183322-16-9
Molecular Formula: C15H22O6
Molecular Weight: 298.33
InChI: InChI=1/C15H22O6/c1-4-19-15(16)12-5-6-13(20-9-7-17-2)14(11-12)21-10-8-18-3/h5-6,11H,4,7-10H2,1-3H3
Molecular Structure: (C15H22O6) 3,4-Bis(2-methoxyethoxy)benzoic acid ethyl ester;
Properties
Density:1.102
Refractive index:1.488
Specification:

The Ethyl 3,4-bis(2-methoxyethoxy)benzoate with cas registry number of 183322-16-9, has the systematic name of ethyl 3,4-bis(2-methoxyethoxy)benzoate. And it is also named benzoic acid, 3,4-bis(2-methoxyethoxy)-, ethyl ester.

Physical properties about this chemical are: (1)ACD/LogP: 1.93; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 6; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 11; (6)Polar Surface Area: 63.22 Å2; (7)Index of Refraction: 1.488; (8)Molar Refractivity: 78.03 cm3; (9)Molar Volume: 270.5 cm3; (10)Polarizability: 30.93×10-24cm3; (11)Surface Tension: 36.1 dyne/cm; (12)Enthalpy of Vaporization: 65.28 kJ/mol; (13)Vapour Pressure: 1.15E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCC)c1cc(OCCOC)c(OCCOC)cc1;
(2)InChI: InChI=1/C15H22O6/c1-4-19-15(16)12-5-6-13(20-9-7-17-2)14(11-12)21-10-8-18-3/h5-6,11H,4,7-10H2,1-3H3;
(3)InChIKey: VGFZRAVMWXHEJB-UHFFFAOYAU;
(4)Std. InChI: InChI=1S/C15H22O6/c1-4-19-15(16)12-5-6-13(20-9-7-17-2)14(11-12)21-10-8-18-3/h5-6,11H,4,7-10H2,1-3H3;
(5)Std. InChIKey: VGFZRAVMWXHEJB-UHFFFAOYSA-N

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