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CAS No.: | 7283-70-7 |
---|---|
Name: | DIISOPROPYL FUMARATE |
Article Data: | 10 |
Molecular Structure: | |
Formula: | C10H16 O4 |
Molecular Weight: | 200.235 |
Synonyms: | 2-Butenedioicacid (2E)-, bis(1-methylethyl) ester (9CI); 2-Butenedioic acid (E)-,bis(1-methylethyl) ester; Fumaric acid, diisopropyl ester (6CI,7CI,8CI);Diisopropyl fumarate; NSC 70161 |
Density: | 1.027g/cm3 |
Melting Point: | 2°C(lit.) |
Boiling Point: | 225.5°C at 760 mmHg |
Flash Point: | 112.3°C |
Safety: | Moderately toxic by ingestion. Mildly toxic by skin contact. A skin and eye irritant. When heated to decomposition it emits acrid smoke and fumes. |
PSA: | 52.60000 |
LogP: | 1.44580 |
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Molecular Structure of Diisopropyl fumarate (CAS NO. 7283-70-7):
EINECS: 230-707-1
Systematic Name: Diisopropyl (E)-but-2-enedioate
Molecular Formula: C10H16O4
Molecular Weight: 200.2316
H bond acceptors: 4
H bond donors: 0
Freely Rotating Bonds: 6
SMILES: O=C(OC(C)C)\C=C\C(=O)OC(C)C
InChI: InChI=1/C10H16O4/c1-7(2)13-9(11)5-6-10(12)14-8(3)4/h5-8H,1-4H3/b6-5+
InChIKey: FNMTVMWFISHPEV-AATRIKPKBJ
Index of Refraction: 1.445
Molar Refractivity: 51.9 cm3
Molar Volume: 194.9 cm3
Surface Tension: 31.3 dyne/cm
Density: 1.027 g/cm3
Flash Point: 112.3 °C
Enthalpy of Vaporization: 46.2 kJ/mol
Boiling Point: 225.5 °C at 760 mmHg
Vapour Pressure: 0.0861 mmHg at 25 °C
Water Solubility of Diisopropyl fumarate (CAS NO. 7283-70-7): 112.6 mg/L at 25 °C
1. | skn-rbt 100 mg/24H MOD | 85JCAE Prehled Prumyslove Toxikologie; Organicke Latky Marhold, J.,Prague, Czechoslovakia.: Avicenum,1986,375. | ||
2. | eye-rbt 500 mg open | AMIHBC AMA Archives of Industrial Hygiene and Occupational Medicine. 10 (1954),61. | ||
3. | orl-rat LD50:3250 mg/kg | AMIHBC AMA Archives of Industrial Hygiene and Occupational Medicine. 10 (1954),61. | ||
4. | skn-rbt LD50:10 g/kg | AMIHBC AMA Archives of Industrial Hygiene and Occupational Medicine. 10 (1954),61. |
Moderately toxic by ingestion. Mildly toxic by skin contact. A skin and eye irritant. When heated to decomposition it emits acrid smoke and fumes.
Diisopropyl fumarate with cas registry number of 7283-70-7 is also known as Fumaricacid,diisopropylester ; (E)-2-Butenedioic acid di(1-methylethyl) ; (E)-2-Butenedioic acid diisopropyl ; Fumaric acid diisopropyl .