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Cas Database |
| Name |
10-Hydroxydecanoic Acid |
EINECS | 216-848-1 |
| CAS No. | 1679-53-4 | Density | 1.013 g/cm3 |
| PSA | 57.53000 | LogP | 2.18410 |
| Solubility | N/A | Melting Point |
75-77 °C(lit.) |
| Formula | C10H20O3 | Boiling Point | 330.8 °C at 760 mmHg |
| Molecular Weight | 188.267 | Flash Point | 168.1 °C |
| Transport Information | N/A | Appearance | White powder crystal |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols |
 Xi
|
| Synonyms |
10-Hydroxydecanoicacid;NSC 15139; |
Article Data | 46 |
10-Hydroxydecanoic Acid Synthetic route
| Conditions | Yield |
|---|---|
| With sodium hydroxide | 99% |
| With potassium hydroxide In ethanol for 2h; Hydrolysis; Heating; | 96.2% |
| With sodium hydroxide In dimethyl sulfoxide for 0.416667h; Thermodynamic data; ΔH; |
- 92038-37-4
10-acetoxydecanoic acid
- 1679-53-4
10-hydroxydecanoic acid
| Conditions | Yield |
|---|---|
| With sodium hydroxide | 92% |
| With potassium hydroxide |
- 52633-92-8
2,2,2-trichloroethyl 10-hydroxydecanoate
- 1679-53-4
10-hydroxydecanoic acid
| Conditions | Yield |
|---|---|
| With tellurium; sodium tetrahydroborate In N,N-dimethyl-formamide Ambient temperature; | 92% |
| Conditions | Yield |
|---|---|
| With sodium tetrahydroborate In tetrahydrofuran at 65℃; for 6h; | A n/a B 10% C 82% |
- 112-43-6
10-Undecen-1-ol
- 64-19-7
acetic acid
A
- 1679-53-4
10-hydroxydecanoic acid
B
- 92038-37-4
10-acetoxydecanoic acid
| Conditions | Yield |
|---|---|
| Stage #1: 10-Undecen-1-ol; acetic acid With ozone In dichloromethane at 0℃; Stage #2: With hydroxylamine hydrochloride In dichloromethane at 0 - 20℃; Reagent/catalyst; Inert atmosphere; | A 21% B 76% |
| Conditions | Yield |
|---|---|
| With aluminium(III) chloride hexahydrate; sodium hydroxide at 190℃; for 6h; Reagent/catalyst; Temperature; Time; Reflux; | 76% |
| Conditions | Yield |
|---|---|
| With copper oxide-chromium oxide; hydrogen at 250℃; under 7355.08 Torr; |
| Conditions | Yield |
|---|---|
| bei der Ozonspaltung; |
| Conditions | Yield |
|---|---|
| (i) O3, MeOH, (ii) NaBH4, aq. NaOH, EtOH, (iii) aq. HCl; Multistep reaction; |
- 91057-51-1
10-Hydroxy-decin-(7)-saeure
- 1679-53-4
10-hydroxydecanoic acid
| Conditions | Yield |
|---|---|
| With hydrogen; palladium on activated charcoal In ethanol |
10-Hydroxydecanoic Acid Specification
The 10-Hydroxydecanoic Acid, with the CAS registry number 1679-53-4, is a kind of crystalline. This chemical could be used to produce Rorifon with the function of depressing cough and reducing inspissated mucus, and it could be used in the synthesis of musk 105, 10-hydroxy-2-decenoic acid and could then be used in the cosmetics. Besides, it is irritant and may cause inflammation to the skin or other mucous membranes. In addition, it has the product categories which are including C10Fatty Acids; Carbonyl Compounds; Carboxylic Acids; Hydroxy fatty acids; Saturated fatty acids and derivatives.
The characteristics of this chemical are as below: (1)ACD/LogP: 1.96; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.16; (4)ACD/LogD (pH 7.4): -0.63; (5)ACD/BCF (pH 5.5): 2.9; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 44.26; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 10; (12)Polar Surface Area: 35.53; (13)Index of Refraction: 1.466; (14)Molar Refractivity: 51.47 cm3; (15)Molar Volume: 185.7 cm3; (16)Polarizability: 20.4×10-24 cm3; (17)Surface Tension: 40.4 dyne/cm; (18)Density: 1.013 g/cm3; (19)Flash Point: 168.1 °C; (20)Enthalpy of Vaporization: 66.45 kJ/mol; (21)Boiling Point: 330.8 °C at 760 mmHg; (22)Vapour Pressure: 1.18E-05 mmHg at 25°C; (23)Exact Mass: 188.141245; (24)MonoIsotopic Mass: 188.141245; (25)Topological Polar Surface Area: 57.5; (26)Heavy Atom Count: 13; (27)Complexity: 123.
Use of this chemical: 10-Hydroxydecanoic Acid could react with methanol to produce 10-hydroxy-decanoic acid methyl ester. This reaction could happen in the presence of the reagent of concentrated sulfuric acid.
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Production method of this chemical: oxacycloundecan-2-one could react to produce 10-hydroxy-decanoic acid. This reaction could happen in the presence of the reagent of aq. NaOH with the yield of 99%.
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In adddition, you could convert the following datas into the molecular structure:
(1)Canonical SMILES: C(CCCCC(=O)O)CCCCO
(2)InChI: InChI=1S/C10H20O3/c11-9-7-5-3-1-2-4-6-8-10(12)13/h11H,1-9H2,(H,12,13)
(3)InChIKey: YJCJVMMDTBEITC-UHFFFAOYSA-N
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