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15419-91-7

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Basic Information
CAS No.: 15419-91-7
Name: Dipropyl sebacate
Article Data: 5
Molecular Structure:
Molecular Structure of 15419-91-7 (Dipropyl sebacate)
Formula: C16H30O4
Molecular Weight: 286.412
Synonyms: Decanedioicacid, dipropyl ester (9CI);Sebacic acid, dipropyl ester (7CI,8CI);Dipropyldecanedioate;Dipropyl sebacate;Nikkol DIS;Decanedioic acid, dipropyl ester;
EINECS: 239-430-0
Density: 0.955 g/cm3
Boiling Point: 326.6 °C at 760 mmHg
Flash Point: 146.4 °C
PSA: 52.60000
LogP: 4.01360
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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