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Dibutyl Sebacate

Catalog Number
ACMA00016915
Product Name
Dibutyl Sebacate
Category
Polymers
Description
Liquid;Liquid;Liquid;COLOURLESS OILY LIQUID.;colourless to oily liquid; fruity but very mild odour with a very faint fruity oily taste
IUPAC Name
dibutyl decanedioate
Molecular Weight
314.5g/mol
Molecular Formula
C18H34O4;CH3(CH2)3O2C(CH2)8CO2(CH2)3CH3;C18H34O4
Canonical SMILES
CCCCOC(=O)CCCCCCCCC(=O)OCCCC
InChI
InChI=1S/C18H34O4/c1-3-5-15-21-17(19)13-11-9-7-8-10-12-14-18(20)22-16-6-4-2/h3-16H2,1-2H3
InChI Key
PYGXAGIECVVIOZ-UHFFFAOYSA-N
Boiling Point
344.5 °C;344.5 °C;344-345 °C
Melting Point
-10.0 °C;Mp 12 °;-10 °C;12°C;-10 °C
Flash Point
353 °F (178 °C) (OPEN CUP);167 °C
Density
d25 0.93;0.9405 @ 15 °C;Relative density (water = 1): 0.9;0.936-0.940 (20?°)
Solubility
1.27e-04 M;0.04 mg/mL at 20 °C;Soluble in ethyl ether;water solubility = 40 mg/l @ 20 °C;0.04 mg/mL at 20 °C;Solubility in water: none;insoluble in water; soluble in alcohol; miscible in oil
Color/Form
Colorless liquid
Complexity
248
Covalently-Bonded Unit Count
1
EC Number
203-672-5
Exact Mass
314.24571g/mol
Formal Charge
0
Heavy Atom Count
22
ICSC Number
1349
MeSH Entry Terms
dibutyl sebacate;dibutylsebacate
Monoisotopic Mass
314.24571g/mol
NSC Number
3893
Odor
Odorless
Refractive Index
n20D 1.4433;Index of refraction: 1.4433 @ 15 °C/D;1.439-1.444
Rotatable Bond Count
17
RTECS Number
VS1150000
UNII
4W5IH7FLNY
Vapor Density
10.8 (Air= 1);Relative vapor density (air = 1): 10.8
Vapor Pressure
4.69e-06 mmHg;4.69X10-6 mm Hg @ 25 °C
XLogP3
5.3
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