Cas no 37704-51-1 (5,5'-propane-1,3-diylbis(1,2-oxazole))
37704-51-1 structure
Product Name:5,5'-propane-1,3-diylbis(1,2-oxazole)
CAS No:37704-51-1
MF:C9H10N2O2
MW:178.187901973724
CID:1485381
PubChem ID:37819
Update Time:2025-04-21
5,5'-propane-1,3-diylbis(1,2-oxazole) Chemical and Physical Properties
Names and Identifiers
-
- 5,5'-propane-1,3-diylbis(1,2-oxazole)
- 5-[3-(5-Isoxazolyl)propyl]isoxazole
- Isoxazole, 5,5'-(1,3-propanediyl)bis-
- 5-[3-(1,2-oxazol-5-yl)propyl]-1,2-oxazole
- 37704-51-1
- DTXSID40191143
- 5,5'-(1,3-PROPANEDIYL)BISISOXOZOLE
- GKAZHGXJGCPBJP-UHFFFAOYSA-N
- 5-[3-(5-Isoxazolyl)propyl]isoxazole #
-
- Inchi： 1S/C9H10N2O2/c1(2-8-4-6-10-12-8)3-9-5-7-11-13-9/h4-7H,1-3H2
- InChI Key： GKAZHGXJGCPBJP-UHFFFAOYSA-N
- SMILES： O1C(=CC=N1)CCCC1=CC=NO1
Computed Properties
- Exact Mass: 178.0743
- Monoisotopic Mass: 178.074227566g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 4
- Complexity: 139
- 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: 1.5
- Topological Polar Surface Area: 52.1?2
Experimental Properties
- PSA: 52.06
5,5'-propane-1,3-diylbis(1,2-oxazole) Related Literature
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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3. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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