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CAS No.: | 7223-42-9 |
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Name: | 3-(PROP-2-YN-1-YLOXY)PYRIDINE |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C7H11N |
Molecular Weight: | 109.171 |
Synonyms: | Pyrrolidine,1-(2-propynyl)- (6CI,7CI,8CI,9CI);1-(2-Propynyl)pyrrolidine;1-Propargylpyrrolidine;N-Propargylpyrrolidine;NSC 172884; |
Density: | 0.928 g/cm3 |
Boiling Point: | 135.4 °C at 760 mmHg |
Flash Point: | 27.6 °C |
PSA: | 3.24000 |
LogP: | 0.65330 |
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The Pyrrolidine, 1-(2-propyn-1-yl)-, with the CAS registry number 7223-42-9, is also known as N-(2-Propynyl)pyrrolidine. This chemical's molecular formula is C7H11N and molecular weight is 109.17. What's more, its IUPAC name is 1-Prop-2-ynylpyrrolidine.
Physical properties about Pyrrolidine, 1-(2-propyn-1-yl)- are: (1)ACD/LogP: 1.14; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 3.24 Å2; (7)Index of Refraction: 1.486; (8)Molar Refractivity: 33.8 cm3; (9)Molar Volume: 117.6 cm3; (10)Polarizability: 13.39×10-24 cm3; (11)Surface Tension: 35.2 dyne/cm; (12)Density: 0.928 g/cm3; (13)Flash Point: 27.6 °C; (14)Enthalpy of Vaporization: 37.28 kJ/mol; (15)Boiling Point: 135.4 °C at 760 mmHg; (16)Vapour Pressure: 7.74 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: C#CCN1CCCC1
(2) InChI: InChI=1/C7H11N/c1-2-5-8-6-3-4-7-8/h1H,3-7H2
(3) InChIKey: IUGUPWHFLZEPHN-UHFFFAOYAN