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| CAS No.: | 63834-30-0 |
|---|---|
| Name: | 3-Ethyl-2-hydroxyheptanoic acid |
| Molecular Structure: | |
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| Formula: | C9H18 O3 |
| Molecular Weight: | 174.27 |
| Synonyms: | 2-Hydroxy-3-ethylheptanoic acid;HEPTANOIC ACID,3-ETHYL-2-HYDROXY; |
| Density: | 1.025g/cm3 |
| Boiling Point: | 296.9°Cat760mmHg |
| Flash Point: | 147.6°C |
| Safety: | Moderately toxic by ingestion and skin contact. A skin irritant. When heated to decomposition it emits acrid smoke and fumes. |
| PSA: | 57.53000 |
| LogP: | 1.64830 |
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Chemistry
Product Name: 2-Hydroxy-3-ethylheptanoic acid (CAS NO.63834-30-0)
Molecular Formula: C9H18O3
Molecular Weight: 174.27g/mol
Mol File: 63834-30-0.mol
Boiling point: 296.9 °C at 760 mmHg
Storage Temperature:
Flash Point: 147.6 °C
Density: 1.025g/cm3
Surface Tension: 38.5 dyne/cm
Enthalpy of Vaporization: 62.26 kJ/mol
Vapour Pressure: 0.000143 mmHg at 25°C
XLogP3-AA: 2.3
H-Bond Donor: 2
H-Bond Acceptor: 3
Rotatable Bond Count: 6
Topological Polar Surface Area: 57.5
Heavy Atom Count: 12
Complexity: 134
Undefined Atom StereoCenter Count: 2
Covalently-Bonded Unit Count: 1
Toxicity Data With Reference
| 1. | skn-rbt 10 mg/24H open | AIHAAP American Industrial Hygiene Association Journal. 23 (1962),95. | ||
| 2. | orl-rat LD50:3400 mg/kg | AIHAAP American Industrial Hygiene Association Journal. 23 (1962),95. | ||
| 3. | skn-rbt LD50:1780 mg/kg | AIHAAP American Industrial Hygiene Association Journal. 23 (1962),95. |
Safety Profile
Moderately toxic by ingestion and skin contact. A skin irritant. When heated to decomposition it emits acrid smoke and fumes.
Specification
2-Hydroxy-3-ethylheptanoic acid ,its CAS NO. is 63834-30-0,the synonyms is 3-Ethyl-2-hydroxyheptanoic acid ; Kyselina 2-hydroxy-3-ethylheptanova ; Heptanoic acid, 3-ethyl-2-hydroxy- .