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| CAS No.: | 1503-98-6 |
|---|---|
| Name: | Cyclobutanecarboxamide |
| Article Data: | 16 |
| Molecular Structure: | |
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| Formula: | C5H9NO |
| Molecular Weight: | 99.1326 |
| Synonyms: | CYCLOBUTANECARBOXAMIDE;Cyclobutanecarboxilic acidaMide |
| Density: | 1.108 g/cm3 |
| Melting Point: | 155 °C |
| Boiling Point: | 254.7 °C at 760 mmHg |
| Flash Point: | 107.8 °C |
| PSA: | 43.09000 |
| LogP: | 0.97210 |
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- Total:38 Page 1 of 1 1
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Specification
This chemical is called Cyclobutanecarboxamide, and its CAS registry number is 1503-98-6. With the molecular formula of C5H9NO, its molecular weight is 99.13. Additionally, its product category is Cycloalkanes.
Other characteristics of the Cyclobutanecarboxamide can be summarised as followings: (1)ACD/LogP: -0.30; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.3; (4)ACD/LogD (pH 7.4): -0.3; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 16.29; (8)ACD/KOC (pH 7.4): 16.29; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 20.31 Å2; (13)Index of Refraction: 1.505; (14)Molar Refractivity: 26.55 cm3; (15)Molar Volume: 89.3 cm3; (16)Polarizability: 10.52×10-24cm3; (17)Surface Tension: 46.5 dyne/cm; (18)Density: 1.108 g/cm3; (19)Flash Point: 107.8 °C; (20)Enthalpy of Vaporization: 49.22 kJ/mol; (21)Boiling Point: 254.7 °C at 760 mmHg; (22)Vapour Pressure: 0.017 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: O=C(N)C1CCC1
2.InChI: InChI=1/C5H9NO/c6-5(7)4-2-1-3-4/h4H,1-3H2,(H2,6,7)
3.InChIKey: MFNYBOWJWGPXFM-UHFFFAOYAI