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CAS No.: | 31739-56-7 |
---|---|
Name: | 2-(1H-PYRROL-1-YL)BENZALDEHYDE |
Article Data: | 7 |
Molecular Structure: | |
Formula: | C11H9NO |
Molecular Weight: | 171.199 |
Synonyms: | 2-(1H-Pyrrol-1-yl)benzaldehyde; |
Density: | 1.06 g/cm3 |
Melting Point: | 156 °C |
Boiling Point: | 312.8 °C at 760 mmHg |
Flash Point: | 143 °C |
PSA: | 22.00000 |
LogP: | 2.28980 |
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The CAS registry number of Benzaldehyde,2-(1H-pyrrol-1-yl)- is 31739-56-7. This chemical's molecular formula is C11H9NO and molecular weight is 171.1953. Its systematic name is called 2-(1H-pyrrol-1-yl)benzaldehyde.
Physical properties of Benzaldehyde,2-(1H-pyrrol-1-yl)-: (1)ACD/LogP: 2.50; (2)#H bond acceptors: 2; (3)#Freely Rotating Bonds: 2; (4)Index of Refraction: 1.573; (5)Molar Refractivity: 52.94 cm3; (6)Molar Volume: 160.6 cm3; (7)Surface Tension: 42.1 dyne/cm; (8)Density: 1.06 g/cm3; (9)Flash Point: 143 °C; (10)Enthalpy of Vaporization: 55.39 kJ/mol; (11)Boiling Point: 312.8 °C at 760 mmHg; (12)Vapour Pressure: 0.000516 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=Cc1ccccc1n2cccc2
(2)InChI: InChI=1/C11H9NO/c13-9-10-5-1-2-6-11(10)12-7-3-4-8-12/h1-9H
(3)InChIKey: BITJMALLHCGYKF-UHFFFAOYAK