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| CAS No.: | 18514-46-0 |
|---|---|
| Name: | N-(TRIPHENYLMETHYL)GLYCINE ETHYL ESTER |
| Molecular Structure: | |
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| Formula: | C23H23NO2 |
| Molecular Weight: | 345.441 |
| Synonyms: | Glycine,N-trityl-, ethyl ester (6CI,8CI);Ethyl N-(triphenylmethyl)glycinate;N-Tritylglycine ethyl ester;NSC 96714; |
| Density: | 1.11 g/cm3 |
| Melting Point: | 110-112 °C |
| Boiling Point: | 459.1 °C at 760 mmHg |
| Flash Point: | 231.4 °C |
| Safety: | 22-24/25 |
| PSA: | 38.33000 |
| LogP: | 4.52210 |
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Specification
The Glycine, N-(triphenylmethyl)-, ethyl ester, with the CAS registry number 18514-46-0, is also known as Ethyl N-tritylglycinate. It belongs to the product category of Amino Ester. This chemical's molecular formula is C23H23NO2 and molecular weight is 345.43. What's more, its IUPAC name is Ethyl 2-(tritylamino)acetate. In addition, it must be stored in airtight containers and placed in a dry, ventilated place at room temperature. Meanwhile, it should be kept away from light, oxidant. In addition, the dust of this chemical can not be breathed. And you should avoid contacting with skin and eyes.
Physical properties about Glycine, N-(triphenylmethyl)-, ethyl ester are: (1)ACD/LogP: 6.51; (2)# of Rule of 5 Violations: 1; (3)#H bond acceptors: 3; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 8; (6)Polar Surface Area: 29.54 Å2; (7)Index of Refraction: 1.579; (8)Molar Refractivity: 103.43 cm3; (9)Molar Volume: 311.1 cm3; (10)Polarizability: 41×10-24 cm3; (11)Surface Tension: 42.9 dyne/cm; (12)Density: 1.11 g/cm3; (13)Flash Point: 231.4 °C; (14)Enthalpy of Vaporization: 71.95 kJ/mol; (15)Boiling Point: 459.1 °C at 760 mmHg; (16)Vapour Pressure: 1.31E-08 mmHg at 25 °C.
Preparation of Glycine, N-(triphenylmethyl)-, ethyl ester: this chemical is prepared by reaction of Glycine ethyl ester; hydrochloride with 4-Dimethylamino-N-triphenylmethylpyridinium chloride. The reaction needs reagent Diisopropylethylamine and solvent Dimethylformamide. The reaction time is 24 hours with reaction temperature of 25 °C. The yield is about 65 %.
-, ethyl ester.png)
Uses of Glycine, N-(triphenylmethyl)-, ethyl ester: it is used to produce other chemicals. For example, it is used to produce N-Triphenylmethyl-2, 2-dideuterioethanolamine at ambient temperature. The reaction needs reagent LAD and solvent Tetrahydrofuran. The reaction time is 2 hours. The yield is about 100 %.
-, ethyl ester.png)
You can still convert the following datas into molecular structure:
(1) SMILES: O=C(OCC)CNC(c1ccccc1)(c2ccccc2)c3ccccc3
(2) InChI: InChI=1/C23H23NO2/c1-2-26-22(25)18-24-23(19-12-6-3-7-13-19,20-14-8-4-9-15-20)21-16-10-5-11-17-21/h3-17,24H,2,18H2,1H3
(3) InChIKey: CAFYNMFIEFNYRA-UHFFFAOYAZ