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1-Propanoylpyrrolidin-2-one

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Name

1-Propanoylpyrrolidin-2-one

EINECS
CAS No. 77015-41-9 Density 1.138 g/cm3
Solubility Melting Point
Formula C7H11NO2 Boiling Point 257.9 °C at 760 mmHg
Molecular Weight 141.17 Flash Point 114.5 °C
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Safety Risk Codes
Molecular Structure Molecular Structure of 77015-41-9 (1-Propanoylpyrrolidin-2-one) Hazard Symbols
Synonyms

1-Propionyl-pyrrolidin-2-one;2-pyrrolidinone, 1-(1-oxopropyl)-;

 

1-Propanoylpyrrolidin-2-one Specification

The 1-Propanoylpyrrolidin-2-one, with the CAS registry number 77015-41-9, is also known as 1-Propionyl-pyrrolidin-2-one. This chemical's molecular formula is C7H11NO2 and molecular weight is 141.17.

Physical properties of 1-Propanoylpyrrolidin-2-one are: (1)ACD/LogP: 0.59; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 37.38 Å2; (7)Index of Refraction: 1.491; (8)Molar Refractivity: 35.98 cm3; (9)Molar Volume: 124 cm3; (10)Polarizability: 14.26×10-24 cm3; (11)Surface Tension: 42.8 dyne/cm; (12)Density: 1.138 g/cm3; (13)Flash Point: 114.5 °C; (14)Enthalpy of Vaporization: 49.54 kJ/mol; (15)Boiling Point: 257.9 °C at 760 mmHg; (16)Vapour Pressure: 0.0142 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C1N(C(=O)CC)CCC1
(2)InChI: InChI=1/C7H11NO2/c1-2-6(9)8-5-3-4-7(8)10/h2-5H2,1H3
(3)InChIKey: MNRCYXHUPGJXOS-UHFFFAOYAA

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