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CAS No.: | 110-25-8 |
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Name: | N-OLEOYLSARCOSINE |
Article Data: | 5 |
Cas Database | |
Molecular Structure: | |
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Formula: | C21H39NO3 |
Molecular Weight: | 353.546 |
Synonyms: | N-OLEOYLSARCOSINE; N-Oleoylsarcosine; N-cis-Octadecenoylsarcosine; |
EINECS: | 203-749-3 |
Density: | 0.961g/cm3 |
Melting Point: | 16.1-17.0oC |
Boiling Point: | 499.4 °C at 760 mmHg |
Flash Point: | 255.9 °C |
Appearance: | light yellow liquid |
Risk Codes: | 36/37/38 |
Safety: | 26-36/37/39 |
PSA: | 57.61000 |
LogP: | 5.56690 |
N-oleoylsarcosine
Conditions | Yield |
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Stage #1: N-oleoylsarcosine methyl ester With lithium hydroxide In ethanol; water at 20℃; for 12h; Stage #2: With hydrogenchloride In water pH=2; | 98% |
Conditions | Yield |
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With water; sodium hydroxide In toluene at 30℃; for 1h; Solvent; | 97.8% |
Conditions | Yield |
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With sodium hydroxide |
Conditions | Yield |
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In water; isopropyl alcohol |
Conditions | Yield |
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Multi-step reaction with 2 steps 1.1: N-ethyl-N,N-diisopropylamine / dichloromethane; methanol / 0 - 20 °C 2.1: lithium hydroxide / ethanol; water / 12 h / 20 °C 2.2: pH 2 View Scheme |
N-oleoylsarcosine
6-nitroveratryl alcohol
4,5-dimethoxy-2-nitrobenzyl [methyl(oleoyl)amino]acetate
Conditions | Yield |
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Stage #1: N-oleoylsarcosine With dmap; dicyclohexyl-carbodiimide In dichloromethane at 0 - 20℃; Inert atmosphere; Stage #2: 6-nitroveratryl alcohol In dichloromethane at 20℃; Inert atmosphere; | 82% |
Conditions | Yield |
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at 150℃; for 3h; Inert atmosphere; Dean-Stark; | |
at 150℃; for 3h; Dean-Stark; Inert atmosphere; | 421.7 g |
at 150℃; for 3h; Dean-Stark; Inert atmosphere; | 421.7 g |
at 150℃; for 3h; Dean-Stark; Inert atmosphere; Reflux; | 421.7 g |
Conditions | Yield |
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at 130℃; for 3h; Inert atmosphere; Dean-Stark; | |
at 130℃; for 3h; Dean-Stark; Inert atmosphere; | 266.6 g |
at 130℃; for 3h; Dean-Stark; Inert atmosphere; | 266.6 g |
at 130℃; for 3h; Dean-Stark; Inert atmosphere; | 266.6 g |
Conditions | Yield |
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With Amberlyst 15 acidic resin at 150℃; for 3h; Inert atmosphere; Dean-Stark; | |
With Amberlyst 15 acidic resin at 150℃; for 3h; Dean-Stark; Inert atmosphere; | 371.6 g |
With Amberlyst 15 acidic resin at 150℃; for 3h; Dean-Stark; Inert atmosphere; | 371.6 g |
With Amberlyst 15 acidic resin at 150℃; for 3h; Dean-Stark; Inert atmosphere; | 371.6 g |
Conditions | Yield |
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With Amberlyst 15 acidic resin for 3h; Inert atmosphere; Dean-Stark; Reflux; | 310 g |
With Amberlyst 15 acidic resin for 3h; Dean-Stark; Reflux; Inert atmosphere; | 310 g |
With Amberlyst 15 acidic resin for 3h; Dean-Stark; Inert atmosphere; Reflux; | 310 g |
With Amberlyst 15 acidic resin for 3h; Dean-Stark; Inert atmosphere; Reflux; | 310 g |
The N-Oleoylsarcosine, with CAS registry number 110-25-8, has the systematic name of N-methyl-N-[(9Z)-octadec-9-enoyl]glycine. This chemical is a kind of light yellow liquid. And the chemical formula of this chemical is C21H39NO3. The main use of this chemical is for corrosion inhibitor. What's more, its EINECS is 203-749-3.The N-Oleoylsarcosine irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.
Physical properties of N-Oleoylsarcosine:
(1)ACD/LogP: 6.885; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 4.59; (4)ACD/LogD (pH 7.4): 3.26; (5)ACD/BCF (pH 5.5): 509.75; (6)ACD/BCF (pH 7.4): 24.10; (7)ACD/KOC (pH 5.5): 671.88; (8)ACD/KOC (pH 7.4): 31.76; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 17; (12)Index of Refraction: 1.481; (13)Molar Refractivity: 104.712 cm3; (14)Molar Volume: 367.791 cm3; (15)Polarizability: 41.511 10-24cm3 ; (16)Surface Tension: 37.0480003356934 dyne/cm; (17)Density: 0.961 g/cm3; (18)Flash Point: 255.851 °C; (19)Enthalpy of Vaporization: 84.061 kJ/mol; (20)Boiling Point: 499.438 °C at 760 mmHg; (21)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES:O=C(N(C)CC(=O)O)CCCCCCC\C=C/CCCCCCCC;
(2)Std. InChI:InChI=1S/C21H39NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20(23)22(2)19-21(24)25/h10-11H,3-9,12-19H2,1-2H3,(H,24,25)/b11-10-;
(3)Std. InChIKey:DIOYAVUHUXAUPX-KHPPLWFESA-N.