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Decanedioic acid,1,10-dipropyl ester

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Name

Decanedioic acid,1,10-dipropyl ester

EINECS 239-430-0
CAS No. 15419-91-7 Density 0.955 g/cm3
PSA 52.60000 LogP 4.01360
Solubility N/A Melting Point N/A
Formula C16H30O4 Boiling Point 326.6 °C at 760 mmHg
Molecular Weight 286.412 Flash Point 146.4 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 15419-91-7 (Decanedioic acid,1,10-dipropyl ester) Hazard Symbols N/A
Synonyms

Decanedioicacid, dipropyl ester (9CI);Sebacic acid, dipropyl ester (7CI,8CI);Dipropyldecanedioate;Dipropyl sebacate;Nikkol DIS;Decanedioic acid, dipropyl ester;

Article Data 5

Decanedioic acid,1,10-dipropyl ester Specification

The Decanedioic acid,1,10-dipropyl ester, with the CAS registry number 15419-91-7, is also known as Decanedioic acid, dipropyl ester. Its EINECS number is 239-430-0. This chemical's molecular formula is C16H30O4 and molecular weight is 286.41. What's more, its systematic name is dipropyl decanedioate.

Physical properties of Decanedioic acid,1,10-dipropyl ester are: (1)ACD/LogP: 4.91; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.91; (4)ACD/LogD (pH 7.4): 4.91; (5)ACD/BCF (pH 5.5): 3185.16; (6)ACD/BCF (pH 7.4): 3185.16; (7)ACD/KOC (pH 5.5): 11197.88; (8)ACD/KOC (pH 7.4): 11197.88; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 15; (12)Polar Surface Area: 52.6 Å2; (13)Index of Refraction: 1.444; (14)Molar Refractivity: 79.72 cm3; (15)Molar Volume: 299.6 cm3; (16)Polarizability: 31.6×10-24cm3; (17)Surface Tension: 33 dyne/cm; (18)Density: 0.955 g/cm3; (19)Flash Point: 146.4 °C; (20)Enthalpy of Vaporization: 56.88 kJ/mol; (21)Boiling Point: 326.6 °C at 760 mmHg; (22)Vapour Pressure: 0.000213 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCCC)CCCCCCCCC(=O)OCCC
(2)InChI: InChI=1S/C16H30O4/c1-3-13-19-15(17)11-9-7-5-6-8-10-12-16(18)20-14-4-2/h3-14H2,1-2H3
(3)InChIKey: UHGPEWTZABDZCE-UHFFFAOYSA-N

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