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88929-35-5

Basic Information
CAS No.: 88929-35-5
Name: Oxiracetam
Article Data: 19
Molecular Structure:
Molecular Structure of 88929-35-5 (Oxiracetam)
Formula: C6H10N2O3
Molecular Weight: 158.157
Synonyms: 1-Pyrrolidineacetamide,4-hydroxy-2-oxo-, (S)-;
EINECS: 200-429-5
Density: 1.416 g/cm3
Melting Point: 165-168 °C
Boiling Point: 494.6 °C at 760 mmHg
Flash Point: 252.9 °C
Hazard Symbols: IrritantXi
Risk Codes: 36/38
Safety: 26/36
PSA: 83.63000
LogP: -1.29690
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Specification

The 1-Pyrrolidineacetamide,4-hydroxy-2-oxo-, (4S)- is an organic compound with the formula C6H10N2O3. The IUPAC name of this chemical is 2-[(4S)-4-hydroxy-2-oxopyrrolidin-1-yl]acetamide. With the CAS registry number 88929-35-5, it is also named as 2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetamide. The product's categories are APIs; Drug Intermediates.

Physical properties about 1-Pyrrolidineacetamide,4-hydroxy-2-oxo-, (4S)- are: (1)ACD/LogP: -2.48; (2)ACD/LogD (pH 5.5): -2.48; (3)ACD/LogD (pH 7.4): -2.48; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1.07; (7)ACD/KOC (pH 7.4): 1.07; (8)#H bond acceptors: 5; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 49.85 Å2; (12)Index of Refraction: 1.57; (13)Molar Refractivity: 36.62 cm3; (14)Molar Volume: 111.6 cm3; (15)Polarizability: 14.51×10-24cm3; (16)Surface Tension: 69.2 dyne/cm; (17)Density: 1.416 g/cm3; (18)Flash Point: 252.9 °C; (19)Enthalpy of Vaporization: 87.77 kJ/mol; (20)Boiling Point: 494.6 °C at 760 mmHg; (21)Vapour Pressure: 7.39E-12 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes and skin. When you are using it, wear suitable protective clothing. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(N)CN1C(=O)CC(O)C1
(2)InChI: InChI=1/C6H10N2O3/c7-5(10)3-8-2-4(9)1-6(8)11/h4,9H,1-3H2,(H2,7,10)
(3)InChIKey: IHLAQQPQKRMGSS-UHFFFAOYAL
(4)Std. InChI: InChI=1S/C6H10N2O3/c7-5(10)3-8-2-4(9)1-6(8)11/h4,9H,1-3H2,(H2,7,10)
(5)Std. InChIKey: IHLAQQPQKRMGSS-UHFFFAOYSA-N

The toxicity data is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intraperitoneal > 1gm/kg (1000mg/kg)   Farmaco, Edizione Scientifica. Vol. 39, Pg. 16, 1984.