Cas no 19768-02-6 (diphenyl-1,2,5-oxadiazole)
diphenyl-1,2,5-oxadiazole structure
Product Name:diphenyl-1,2,5-oxadiazole
CAS No:19768-02-6
MF:C14H10N2O
MW:222.24200296402
CID:864963
PubChem ID:140581
Update Time:2025-04-19
diphenyl-1,2,5-oxadiazole Chemical and Physical Properties
Names and Identifiers
-
- diphenyl-1,2,5-oxadiazole
- 3,4-diphenyl-1,2,5-oxadiazole
- 3,4-Diphenylfurazan
- Diphenylfurazan
- Furazan, diphenyl-
-
- Inchi： 1S/C14H10N2O/c1-3-7-11(8-4-1)13-14(16-17-15-13)12-9-5-2-6-10-12/h1-10H
- InChI Key： RIIIXRZGXAJVEQ-UHFFFAOYSA-N
- SMILES： O1N=C(C2C=CC=CC=2)C(C2C=CC=CC=2)=N1
Computed Properties
- Exact Mass: 222.0794
- Monoisotopic Mass: 222.079
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 17
- Rotatable Bond Count: 2
- Complexity: 210
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.8
- Topological Polar Surface Area: 38.9?2
Experimental Properties
- Density: 1.174
- Boiling Point: 336.2°C at 760 mmHg
- Flash Point: 151.3°C
- Refractive Index: 1.59
- PSA: 38.92
diphenyl-1,2,5-oxadiazole Related Literature
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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Kathrin Kutlescha,Rhett Kempe New J. Chem., 2010,34, 1954-1960
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Dhamodaran Manikandan,S. Amirthapandian,I. S. Zhidkov,A. I. Kukharenko,S. O. Cholakh,Ramaswamy Murugan Phys. Chem. Chem. Phys., 2018,20, 6500-6514
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