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71850-03-8

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Basic Information
CAS No.: 71850-03-8
Name: bis(2-methoxyethyl) sebacate
Molecular Structure:
Molecular Structure of 71850-03-8 (bis(2-methoxyethyl) sebacate)
Formula: C16H30 O6
Molecular Weight: 318.46
Synonyms: Decanedioicacid, bis(2-methoxyethyl) ester (9CI); Sebacic acid, bis(2-methoxyethyl) ester(7CI)
Density: 1.019g/cm3
Boiling Point: 377.9°C at 760 mmHg
Flash Point: 160.6°C
Safety: Low toxicity by ingestion. When heated to decomposition it emits acrid smoke and irritating vapors.
PSA: 71.06000
LogP: 2.48640
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  • Decanedioic acid,1,10-bis(2-methoxyethyl) ester

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    71850-03-8

    Decanedioic acid,1,10-bis(2-methoxyethyl) ester

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  • Decanedioic acid,1,10-bis(2-methoxyethyl) ester

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    71850-03-8

    Decanedioic acid,1,10-bis(2-methoxyethyl) ester

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Chemistry

Molecule structure of Decanedioic acid, bis(2-methoxyethyl) ester (CAS NO.71850-03-8):

IUPAC Name: Bis(2-methoxyethyl) decanedioate 
Molecular Weight: 318.4058 g/mol
Molecular Formula: C16H30O6 
Density: 1.019 g/cm3 
Boiling Point: 377.9 °C at 760 mmHg 
Flash Point: 160.6 °C
Index of Refraction: 1.445
Molar Refractivity: 83.21 cm3
Molar Volume: 312.3 cm3
Polarizability: 32.98×10-24 cm3
Surface Tension: 34.5 dyne/cm 
Enthalpy of Vaporization: 62.58 kJ/mol
Vapour Pressure: 6.51E-06 mmHg at 25 °C
XLogP3-AA: 2.5
H-Bond Acceptor: 6
Rotatable Bond Count: 17
Exact Mass: 318.204239
MonoIsotopic Mass: 318.204239
Topological Polar Surface Area: 71.1
Heavy Atom Count: 22
Complexity: 252
Canonical SMILES: COCCOC(=O)CCCCCCCCC(=O)OCCOC
InChI: InChI=1S/C16H30O6/c1-19-11-13-21-15(17)9-7-5-3-4-6-8-10-16(18)22-14-12-20-2/h3-14H2,1-2H3
InChIKey: JGDURTCBAJOZDJ-UHFFFAOYSA-N
EINECS of Decanedioic acid, bis(2-methoxyethyl) ester (CAS NO.71850-03-8): 276-086-0

Toxicity Data With Reference

1.    

orl-rat LD50:4970 mg/kg

     GISAAA    Gigiena i Sanitariya. 56 (5)(1991),61.
2.    

orl-mus LD50:4700 mg/kg

     GISAAA    Gigiena i Sanitariya. 56 (5)(1991),61.

Safety Profile

Low toxicity by ingestion. When heated to decomposition it emits acrid smoke and irritating vapors.

Specification

 Decanedioic acid, bis(2-methoxyethyl) ester (CAS NO.71850-03-8) is also named as AI3-03527 ; Bis(2-methoxyethyl) sebacate .