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1H-Pyrrole,2,3,5-triphenyl-

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Name

1H-Pyrrole,2,3,5-triphenyl-

EINECS
CAS No. 3274-61-1 Density 1.12g/cm3
Solubility Melting Point
Formula C22H17N Boiling Point 462.1 °C at 760 mmHg
Molecular Weight 295.3771 Flash Point 194.1 °C
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Safety Risk Codes
Molecular Structure Molecular Structure of 3274-61-1 (1H-Pyrrole,2,3,5-triphenyl-) Hazard Symbols
Synonyms

 

1H-Pyrrole,2,3,5-triphenyl- Specification

The CAS registry number of 1H-Pyrrole,2,3,5-triphenyl- is 3274-61-1. This chemical's molecular formula is C22H17N and molecular weight is 295.3771. What's more, both its IUPAC name and systematic name are the same which is called 2,3,5-Triphenyl-1H-pyrrole.

Physical properties about 1H-Pyrrole,2,3,5-triphenyl- are: (1)ACD/LogP: 6.84; (2)#of Rule of 5 Violations: 1; (3)#H bond acceptors: 1; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 4.93 Å2; (7)Index of Refraction: 1.635; (8)Molar Refractivity: 94.46 cm3; (9)Molar Volume: 263.6 cm3; (10)Surface Tension: 46.1 dyne/cm; (11)Density: 1.12 g/cm3; (12)Flash Point: 194.1 °C; (13)Enthalpy of Vaporization: 69.53 kJ/mol; (14)Boiling Point: 462.1 °C at 760 mmHg; (15)Vapour Pressure: 2.81E-08 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: c4ccc(c2cc(c(c1ccccc1)n2)c3ccccc3)cc4
(2) InChI: InChI=1/C22H17N/c1-4-10-17(11-5-1)20-16-21(18-12-6-2-7-13-18)23-22(20)19-14-8-3-9-15-19/h1-16,23H
(3) InChIKey: GBCJQOITJVEDQO-UHFFFAOYAL

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