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| CAS No.: | 84600-66-8 |
|---|---|
| Name: | CAPRIC ACID-1-13C |
| Article Data: | 2 |
| Molecular Structure: | |
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| Formula: | C913CH20O2 |
| Molecular Weight: | 173.257 |
| Synonyms: | CAPRIC ACID-1-13C;DECANOIC ACID-1-13C;decanoic-1-13C acid;DECANOIC-1-13C ACID, 99 ATOM % 13C;Decanoic Acid-13C |
| Density: | 0.915 g/cm3 |
| Melting Point: | 30-32 °C |
| Boiling Point: | 268-270 °C(lit.) |
| Flash Point: | 110℃ |
| Hazard Symbols: |
 Xi
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| Risk Codes: | 36/37/38 |
| Safety: | 26-36 |
| PSA: | 37.30000 |
| LogP: | 3.21170 |
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Specification
The Decanoic-1-13C acid(9CI), with the CAS registry number 84600-66-8, is also known as Capric acid-1-13C. This chemical's molecular formula is C913CH20O2 and molecular weight is 173.2573. Its systematic name is called decanoic acid. What's more, the product should be sealed and stored in cool, dry and well-ventilated place.
Physical properties of Decanoic-1-13C acid(9CI): (1)Index of Refraction: 1.443; (2)Molar Refractivity: 49.94 cm3; (3)Molar Volume: 188.2 cm3; (4)Surface Tension: 33.1 dyne/cm; (5)Density: 0.915 g/cm3.
Preparation of Decanoic-1-13C acid(9CI): this chemical can be prepared by decanonitrile-1-13C. This reaction will need reagents glacial acetic acid, H2O, concd. H2SO4. The reaction time is 22 hours. The yield is about 91.9%.
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Uses of Decanoic-1-13C acid(9CI): it can be used to produce 1-decanol-1-13C at ambient temperature. This reaction will need reagent LiAlH4 and solvent tetrahydrofuran with reaction time of 10 hours. The yield is about 85.7%.
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When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing.
You can still convert the following datas into molecular structure:
(1)SMILES: CCCCCCCCCC(=O)O
(2)InChI: InChI=1/C10H20O2/c1-2-3-4-5-6-7-8-9-10(11)12/h2-9H2,1H3,(H,11,12)/i10+1
(3)InChIKey: GHVNFZFCNZKVNT-DETAZLGJEB