-
Name
2,2-Dimethyl-3-oxo-pyrrolidine-1-carboxylic acid ethyl ester
- EINECS
- CAS No. 106556-66-5
- Density 1.097 g/cm3
- Solubility
- Melting Point
- Formula C9H15NO3
- Boiling Point 263.7 °C at 760 mmHg
- Molecular Weight 185.223
- Flash Point 113.3 °C
- Transport Information
- Appearance
- Safety
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms 2,2-Dimethyl-3-oxo-pyrrolidine-1-carboxylic acid ethyl ester;Ethyl 2,2-dimethyl-3-oxo-pyrrolidine-1-carboxylate;1-Pyrrolidinecarboxylic acid, 2,2-diMethyl-3-oxo-, ethyl ester;2,2-Dimethyl-3-oxo-1-pyrrolidinecarboxylic acid ethyl ester;Ethyl 2,2-diMethyl-3-oxo-pyrrolidine-1-carboxylate ethyl
- PSA 46.61000
- LogP 1.13420
1-Pyrrolidinecarboxylicacid, 2,2-dimethyl-3-oxo-, ethyl ester Specification
This chemical is called 1-Pyrrolidinecarboxylicacid, 2,2-dimethyl-3-oxo-, ethyl ester, and its IUPAC name is ethyl 2,2-dimethyl-3-oxopyrrolidine-1-carboxylate. With the molecular formula of C9H15NO3, its molecular weight is 185.22. The CAS registry number of this chemical is 106556-66-5.
Other characteristics of the 1-Pyrrolidinecarboxylicacid, 2,2-dimethyl-3-oxo-, ethyl ester can be summarised as followings: (1)ACD/LogP: 0.36; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.36; (4)ACD/LogD (pH 7.4): 0.36; (5)#H bond acceptors: 4; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 2; (8)Polar Surface Area: 46.61 Å2; (9)Index of Refraction: 1.469; (10)Molar Refractivity: 47.04 cm3; (11)Molar Volume: 168.8 cm3; (12)Polarizability: 18.65×10-24cm3; (13)Surface Tension: 36.2 dyne/cm; (14)Density: 1.097 g/cm3; (15)Flash Point: 113.3 °C; (16)Enthalpy of Vaporization: 50.15 kJ/mol; (17)Boiling Point: 263.7 °C at 760 mmHg; (18)Vapour Pressure: 0.0101 mmHg at 25°C.
Uses of this chemical: The ethyl 4,4-dibromo-2,2-dimethyl-3-oxopyrrolidine-1-carboxylate could be obtained by the reactant of 1-Pyrrolidinecarboxylicacid, 2,2-dimethyl-3-oxo-, ethyl ester. This reaction needs the reagent of Br2, and the solvent of CCl4. The yield is 91 %.
You can still convert the following datas into molecular structure:
1.SMILES: CC1(C)C(=O)CCN1C(=O)OCC
2.InChI: InChI=1/C9H15NO3/c1-4-13-8(12)10-6-5-7(11)9(10,2)3/h4-6H2,1-3H3
3.InChIKey: HWPDAUHYYHRPNF-UHFFFAOYAA
Related Products
- 1-Pyrrolidinecarboxylicacid, 2-(2-aminoethyl)-, 1,1-dimethylethyl ester, (2S)-
- 1-Pyrrolidinecarboxylicacid, 2-(aminocarbonyl)-, phenylmethyl ester, (2R)-
- 1-Pyrrolidinecarboxylicacid, 2-(bromomethyl)-, 1,1-dimethylethyl ester,(2R)-
- 1-Pyrrolidinecarboxylicacid, 2-(hydroxymethyl)-, 9H-fluoren-9-ylmethyl ester, (2S)-
- 1-Pyrrolidinecarboxylicacid, 2,2-dimethyl-3-oxo-, ethyl ester
- 1-Pyrrolidinecarboxylicacid, 2-amino-, 1,1-dimethylethyl ester
- 1-Pyrrolidinecarboxylicacid, 2-ethynyl-, 1,1-dimethylethyl ester
- 1-Pyrrolidinecarboxylicacid, 2-methyl-, 1,1-dimethylethyl ester, (2R)-
- 1-Pyrrolidinecarboxylicacid, 3-(2-aminoethyl)-, phenylmethyl ester
- 1-Pyrrolidinecarboxylicacid, 3-(acetylamino)-, 1,1-dimethylethyl ester, (3S)-
- 106-55-8
- 106560-14-9
- 106568-79-0
- 106-57-0
- 106576-32-3
- 106576-36-7
- 106578-18-1
- 106-58-1
- 106596-81-0
- 106-60-5
Hot Products
About|Contact|Cas|Product Name|Molecular|Country|Encyclopedia
Message|New Cas|MSDS|Service|Advertisement|CAS DataBase|Article Data|Manufacturers | Chemical Catalog
©2008 LookChem.com,License: ICP
NO.:Zhejiang16009103
complaints:service@lookchem.com Desktop View