Products Categories
CAS No.: | 938-54-5 |
---|---|
Name: | (S)-(-)-1-ETHYL-2-PYRROLIDINECARBOXYLIC ACID ETHYL ESTER |
Article Data: | 6 |
Molecular Structure: | |
Formula: | C9H17NO2 |
Molecular Weight: | 171.239 |
Synonyms: | Proline,1-ethyl-, ethyl ester (6CI,7CI,8CI);ethyl (2S)-1-ethylpyrrolidine-2-carboxylate;Ethyl 1-ethyl-L-prolinate;L-proline, 1-ethyl-, ethyl ester;Ethyl (S)-(-)-1-Ethyl-2-pyrrolidinecarboxylate; |
Density: | 0.999 g/cm3 |
Boiling Point: | 209.367 °C at 760 mmHg |
Flash Point: | 73.033 °C |
Risk Codes: | 36/37/38 |
Safety: | 36/37/39 |
PSA: | 29.54000 |
LogP: | 0.97170 |
What can I do for you?
Get Best Price
The L-Proline, 1-ethyl-,ethyl ester, with the CAS registry number 938-54-5, has the systematic name of ethyl (2S)-1-ethylpyrrolidine-2-carboxylate. It belongs to the following product categories: Amino Acid Ethyl Esters; Amino Acids; Amino Acids (C-Protected); Biochemistry; Chiral Building Blocks; Esters (Chiral); Synthetic Organic Chemistry. And the molecular formula of the chemical is C9H17NO2.
The characteristics of L-Proline, 1-ethyl-,ethyl ester are as followings: (1)ACD/LogP: 0.03; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1; (4)ACD/LogD (pH 7.4): 0; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 7; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 29.54 Å2; (13)Index of Refraction: 1.46; (14)Molar Refractivity: 46.923 cm3; (15)Molar Volume: 171.47 cm3; (16)Polarizability: 18.602×10-24cm3; (17)Surface Tension: 32.911 dyne/cm; (18)Density: 0.999 g/cm3; (19)Flash Point: 73.033 °C; (20)Enthalpy of Vaporization: 44.564 kJ/mol; (21)Boiling Point: 209.367 °C at 760 mmHg; (22)Vapour Pressure: 0.204 mmHg at 25°C.
You should be cautious while dealing with this chemical. It irritates to eyes, respiratory system and skin. Therefore, you had better wear suitable protective clothing, gloves and eye/face protection.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: CCN1CCCC1C(=O)OCC
(2)InChI: InChI=1/C9H17NO2/c1-3-10-7-5-6-8(10)9(11)12-4-2/h8H,3-7H2,1-2H3/t8-/m0/s1
(3)InChIKey: CUDOPASYFARLIF-QMMMGPOBBK