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CAS No.: | 506-48-9 |
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Name: | Octacosanoic acid |
Article Data: | 16 |
Molecular Structure: | |
Formula: | C28H56O2 |
Molecular Weight: | 424.751 |
Synonyms: | Montanic acid;n-Octacosanoic acid; |
EINECS: | 208-041-8 |
Density: | 0.875 g/cm3 |
Melting Point: | 91-93 °C(lit.) |
Boiling Point: | 430.5 °C at 760 mmHg |
Flash Point: | 192.5 °C |
Appearance: | white fine crystalline powder |
PSA: | 37.30000 |
LogP: | 10.23350 |
octacosanoic acid
Conditions | Yield |
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With hydrogen; palladium on activated charcoal In methanol at 45℃; under 19001.3 Torr; for 6h; | 96% |
Conditions | Yield |
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With methanol; sodium Electrolysis.Behandlung des Reaktionsprodukts mit methanol.Natronlauge; |
Conditions | Yield |
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With chromium; acetic acid | |
Jones Oxidation; |
10-oxo-octacosanoic acid
octacosanoic acid
Conditions | Yield |
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With sodium hydroxide; hydrazine hydrate; ethylene glycol at 220℃; | |
With hydrogenchloride; amalgamated zinc; acetic acid |
5-oxo-octacosanoic acid methylamide
octacosanoic acid
Conditions | Yield |
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With sodium; hydrazine hydrate; ethylene glycol at 200℃; |
13-Keto-octacosansaeure
octacosanoic acid
Conditions | Yield |
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With sodium hydroxide; hydrazine hydrate In ethylene glycol |
Octacosanoic acid 1-acetoxymethyl-2-octacosanoyloxy-ethyl ester
octacosanoic acid
Conditions | Yield |
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With potassium hydroxide In ethanol |
Conditions | Yield |
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With potassium hydroxide In ethanol for 6h; Heating; |
octacosanoic acid
Conditions | Yield |
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at 140 - 150℃; im Hochvakuum; |
N-methyladipinimide
octacosanoic acid
Conditions | Yield |
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Multi-step reaction with 2 steps 1: diethyl ether / beim Erhitzen zuletzt bis auf 120grad 2: hydrazine hydrate; ethylene glycol; sodium / 200 °C View Scheme |
The Octacosanoic acid, with the CAS registry number 506-48-9, is also known as n-Octacosanoic acid. Its EINECS number is 208-041-8. It belongs to the product categories of Alkylcarboxylic Acids; Monofunctional & alpha,omega-Bifunctional Alkanes; Monofunctional Alkanes. This chemical's molecular formula is C28H56O2 and molecular weight is 424.74. Complied with the regulations of use and storage, it does not decompose. It should be sealed and stored in a cool and dry place and be protected from oxidizes. It can be produced by the oxidation of octacosanol and used in organic synthesis.
Physical properties of Octacosanoic acid are: (1)ACD/LogP: 13.53; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 12.73; (4)ACD/LogD (pH 7.4): 10.94; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 10000000; (8)ACD/KOC (pH 7.4): 1400535.5; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 26; (12)Polar Surface Area: 26.3 Å2; (13)Index of Refraction: 1.461; (14)Molar Refractivity: 133.33 cm3; (15)Molar Volume: 485.3 cm3; (16)Polarizability: 52.85×10-24 cm3; (17)Surface Tension: 33.5 dyne/cm; (18)Density: 0.875 g/cm3; (19)Flash Point: 192.5 °C; (20)Enthalpy of Vaporization: 72.31 kJ/mol; (21)Boiling Point: 430.5 °C at 760 mmHg; (22)Vapour Pressure: 3.55E-08 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O
(2)InChI: InChI=1S/C28H56O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28(29)30/h2-27H2,1H3,(H,29,30)
(3)InChIKey: UTOPWMOLSKOLTQ-UHFFFAOYSA-N