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2-(Pyrrolidin-2-yl)ethanol

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Name

2-(Pyrrolidin-2-yl)ethanol

EINECS 243-055-8
CAS No. 19432-88-3 Density 0.961g/cm3
PSA 32.26000 LogP 0.44960
Solubility N/A Melting Point N/A
Formula C6H13NO Boiling Point 214.5 °C at 760 mmHg
Molecular Weight 115.175 Flash Point 107.3 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 19432-88-3 (pyrrolidine-2-ethanol) Hazard Symbols N/A
Synonyms

2-(2-Hydroxyethyl)pyrrolidine;

Article Data 5

2-(Pyrrolidin-2-yl)ethanol Specification

The 2-Pyrrolidineethanol, with CAS registry number 19432-88-3, belongs to the following product category: Pharmacetical. It has the systematic name of 2-(pyrrolidin-2-yl)ethanol. Besides this, it is also called 2-(pyrrolidin-2-yl)ethanol. And the chemical formula of this chemical is C6H13NO. What's more, its EINECS is 243-055-8.

Physical properties of 2-Pyrrolidineethanol: (1)ACD/LogP: 0.40; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.7; (4)ACD/LogD (pH 7.4): -2.56; (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): 1; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 12.47 Å2; (13)Index of Refraction: 1.457; (14)Molar Refractivity: 32.65 cm3; (15)Molar Volume: 119.8 cm3; (16)Polarizability: 12.94×10-24cm3; (17)Surface Tension: 36.1 dyne/cm; (18)Density: 0.961 g/cm3; (19)Flash Point: 107.3 °C; (20)Enthalpy of Vaporization: 52.44 kJ/mol; (21)Boiling Point: 214.5 °C at 760 mmHg; (22)Vapour Pressure: 0.034 mmHg at 25°C.

Preparation: this chemical can be prepared by 2-pyrrol-2-yl-ethanol. This reaction will need reagent H2 and catalyst PtO2 and solvent acetic acid. The yield is about 67.6%.

Preparation: this chemical can be prepared by 2-pyrrol-2-yl-ethanol.

Uses of 2-Pyrrolidineethanol: it can be used to produce hexahydro-5-oxa-4-thia-3a-aza-indene 4-oxide. This reaction will need reagents hexahydro-5-oxa-4-thia-3a-aza-indene 4-oxide and solvent benzene. The reaction temperature is -10 - 0 ℃. The yield is about 31%.

Uses of 2-Pyrrolidineethanol: it can be used to produce hexahydro-5-oxa-4-thia-3a-aza-indene 4-oxide.

You can still convert the following datas into molecular structure:
(1)SMILES: OCCC1NCCC1
(2)InChI: InChI=1/C6H13NO/c8-5-3-6-2-1-4-7-6/h6-8H,1-5H2
(3)InChIKey: JZXVADSBLRIAIB-UHFFFAOYAM
(4)Std. InChI: InChI=1S/C6H13NO/c8-5-3-6-2-1-4-7-6/h6-8H,1-5H2
(5)Std. InChIKey: JZXVADSBLRIAIB-UHFFFAOYSA-N

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