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19139-31-2

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Basic Information
CAS No.: 19139-31-2
Name: DI-N-HEXYL FUMARATE
Article Data: 4
Molecular Structure:
Molecular Structure of 19139-31-2 (DI-N-HEXYL FUMARATE)
Formula: C16H28 O4
Molecular Weight: 284.396
Synonyms: 2-Butenedioicacid (2E)-, dihexyl ester (9CI);2-Butenedioic acid (E)-, dihexyl ester;Fumaric acid, dihexyl ester (6CI,7CI,8CI);Dihexyl fumarate;
EINECS: 242-833-4
Density: 0.969g/cm3
Boiling Point: 359.1°Cat760mmHg
Flash Point: 167.4°C
Solubility: 150μg/L at 20℃
Safety: A skin irritant. When heated to decomposition it emits acrid smoke and irritating fumes.
PSA: 52.60000
LogP: 3.78960
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Chemistry

Product Name: Dihexyl fumarate (CAS NO.19139-31-2)


Molecular Formula: C16H28O4
Molecular Weight: 284.39g/mol
Mol File: 19139-31-2.mol
Einecs: 242-833-4
Boiling point: 359.1 °C at 760 mmHg
Flash Point: 167.4 °C
Density: 0.969 g/cm3
Surface Tension: 33.4 dyne/cm
Enthalpy of Vaporization: 60.47 kJ/mol
Vapour Pressure: 2.43E-05 mmHg at 25°C
XLogP3-AA: 4.9
H-Bond Donor: 0
H-Bond Acceptor: 4
Rotatable Bond Count: 14
Topological Polar Surface Area: 52.6
Heavy Atom Count: 20
Complexity: 256
Defined Bond StereoCenter Count: 1
Covalently-Bonded Unit Count: 1

Toxicity Data With Reference

1.    

skn-rbt 500 mg/24H MLD

     FCTXAV    Food and Cosmetics Toxicology. 16 (1978),709.

Consensus Reports

Reported in EPA TSCA Inventory.

Safety Profile

A skin irritant. When heated to decomposition it emits acrid smoke and irritating fumes.

Specification

 Dihexyl fumarate ,its CAS NO. is 19139-31-2,the synonyms is 2-Butenedioic acid (E)-, dihexyl ester ; 2-Butenedioicacid(2E)-,dihexylester ; Dihexyl (2E)-2-butenedioate ; Dihexyl trans-butenedioate ; Dihexyltrans-butenedioate ; Fumaric acid, dihexyl ester ; Fumaricacid,dihexylester ; Hexyl fumarate .