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Cas Database |
| Name |
9-Undecenoic acid, methyl ester |
EINECS | N/A |
| CAS No. | 5760-50-9 | Density | 0.886g/cm3 |
| PSA | 26.30000 | LogP | 3.46620 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C12H22 O2 | Boiling Point | 252.8°C at 760 mmHg |
| Molecular Weight | 198.305 | Flash Point | 84.3°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | A skin irritant. When heated to decomposition it emits acrid smoke and irritating fumes. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Methyl9-undecenoate |
Article Data | 7 |
9-Undecenoic acid, methyl ester Chemical Properties
Molecular Formula: C12H22O2
Molecular Weight: 198.301880 g/mol
The Molecular Structure of 9-Undecenoic acid, methyl ester (CAS NO.5760-50-9):.gif)
Classification: Skin / Eye Irritant
IUPAC: methyl (E)-undec-9-enoate
Nominal Mass: 198 Da
Average Mass: 198.3019 Da
Monoisotopic Mass: 198.16198 Da
ACD/LogD (pH 7.4): 4.44
Index of Refraction: 1.444
Molar Refractivity: 59.47 cm3
Molar Volume: 223.7 cm3
Surface Tension: 29.5 dyne/cm
Density: 0.886 g/cm3
Flash Point: 84.3 °C
Enthalpy of Vaporization: 49.01 kJ/mol
Boiling Point: 252.8 °C at 760 mmHg
Vapour Pressure: 0.019 mmHg at 25°C
InChI: InChI=1/C12H22O2/c1-3-4-5-6-7-8-9-10-11-12(13)14-2/h3-4H,5-11H2,1-2H3/b4-3+
Smiles: COC(CCCCCCC\C=C\C)=O
9-Undecenoic acid, methyl ester Toxicity Data With Reference
| 1. | skn-rbt 500 mg/24H MOD | FCTOD7 Food and Chemical Toxicology. 20 (1982),767. | ||
| 2. | orl-rat LD50:3 g/kg | FCTOD7 Food and Chemical Toxicology. 20 (1982),767. |
9-Undecenoic acid, methyl ester Consensus Reports
Reported in EPA TSCA Inventory.
9-Undecenoic acid, methyl ester Safety Profile
A skin irritant. When heated to decomposition it emits acrid smoke and irritating fumes.
9-Undecenoic acid, methyl ester Specification
9-Undecenoic acid, methyl ester (CAS NO.5760-50-9) is also called as EINECS 227-279-3 ; FEMA No. 2750 ; Methyl 9-undecenoate ; Methyl 9-undecylenate ; Methyl undecylenate ; 9-Undecenoic acid, methyl ester ; Methyl undec-9-enoate ; Methyl undecylenate .
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