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| CAS No.: | 84966-28-9 |
|---|---|
| Name: | 5-PYRROLIDIN-1-YL-2-FURALDEHYDE |
| Molecular Structure: | |
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| Formula: | C9H11NO2 |
| Molecular Weight: | 165.192 |
| Synonyms: | 5-(1-Pyrrolidinyl)-2-furaldehyde;5-(1-Pyrrolidino)-2-furaldehyde;5-Pyrrolidin-1-ylfuran-2-carbaldehyde;5-pyrrolidin-1-yl-2-furaldehyde(SALTDATA: FREE) |
| Density: | 1.193 g/cm3 |
| Melting Point: | 82-84℃ |
| Boiling Point: | 315.3 °C at 760 mmHg |
| Flash Point: | 144.5 °C |
| PSA: | 33.45000 |
| LogP: | 1.75730 |
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Specification
This chemical is called 5-(1-Pyrrolidino)-2-furaldehyde, and it can also be named as 5-Pyrrolidin-1-ylfuran-2-carbaldehyde. With the molecular formula of C9H11NO2, its molecular weight is 165.19. The CAS registry number of this chemical is 84966-28-9, and its product categories are Aldehydes; Furans, Benzofurans & Dihydrobenzofurans; Furans, Benzofurans & Dihydrobenzofurans.
Other characteristics of the 5-(1-Pyrrolidino)-2-furaldehyde can be summarised as followings: (1)ACD/LogP: 0.93; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 33.45 Å2; (7)Index of Refraction: 1.571; (8)Molar Refractivity: 45.51 cm3; (9)Molar Volume: 138.4 cm3; (10)Polarizability: 18.04×10-24cm3; (11)Surface Tension: 47.3 dyne/cm; (12)Density: 1.193 g/cm3; (13)Flash Point: 144.5 °C; (14)Enthalpy of Vaporization: 55.65 kJ/mol; (15)Boiling Point: 315.3 °C at 760 mmHg; (16)Vapour Pressure: 0.000442 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: O=Cc2oc(N1CCCC1)cc2
2.InChI: InChI=1/C9H11NO2/c11-7-8-3-4-9(12-8)10-5-1-2-6-10/h3-4,7H,1-2,5-6H2
3.InChIKey: TZLGFEAULCWLDT-UHFFFAOYAL