Name: ethyl thiazolidine-4-carboxylate
SKU: 51977-21-0

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Basic Information

Molecular Structure:
CAS No.:	51977-21-0
Name:	ethyl thiazolidine-4-carboxylate

Formula:	C₆H₁₁NO₂S
Molecular Weight:	161.225
Synonyms:	Ethyl4-thiazolidinecarboxylate;Ethyl 1,3-thiazolidine-4-carboxylate;
EINECS:	257-567-4
Density:	1.165 g/cm³
Boiling Point:	254.2 °C at 760 mmHg
Flash Point:	107.6 °C
PSA:	63.63000
LogP:	0.54080

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Specification

The CAS register number of Ethyl thiazolidine-4-carboxylate is 51977-21-0. It also can be called as 4-Thiazolidinecarboxylicacid, ethyl ester and the IUPAC name about this chemical is ethyl 1,3-thiazolidine-4-carboxylate. The molecular formula about this chemical is C₆H₁₁NO₂S and the molecular weight is 161.22.

Physical properties about Ethyl thiazolidine-4-carboxylate are: (1)ACD/LogP: 0.61; (2)ACD/LogD (pH 5.5): -0.8; (3)ACD/LogD (pH 7.4): 0.49; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1.29; (6)ACD/KOC (pH 5.5): 2; (7)ACD/KOC (pH 7.4): 38.68; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 54.84Å²; (12)Index of Refraction: 1.503; (13)Molar Refractivity: 40.92 cm³; (14)Molar Volume: 138.3 cm³; (15)Polarizability: 16.22x10^-24cm³; (16)Surface Tension: 38.5 dyne/cm; (17)Enthalpy of Vaporization: 49.17 kJ/mol; (18)Boiling Point: 254.2 °C at 760 mmHg; (19)Vapour Pressure: 0.0174 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCC)C1NCSC1
(2)InChI: InChI=1/C6H11NO2S/c1-2-9-6(8)5-3-10-4-7-5/h5,7H,2-4H2,1H3
(3)InChIKey: ZRBNETYZYOXTLS-UHFFFAOYAU
(4)Std. InChI: InChI=1S/C6H11NO2S/c1-2-9-6(8)5-3-10-4-7-5/h5,7H,2-4H2,1H3
(5)Std. InChIKey: ZRBNETYZYOXTLS-UHFFFAOYSA-N