Cas no 64257-90-5 (3H-Phenoxazin-3-one, 7-butoxy-)
64257-90-5 structure
Product Name:3H-Phenoxazin-3-one, 7-butoxy-
CAS No:64257-90-5
MF:C16H15NO3
MW:269.295204401016
CID:424357
PubChem ID:71380205
Update Time:2025-04-19
3H-Phenoxazin-3-one, 7-butoxy- Chemical and Physical Properties
Names and Identifiers
-
- 3H-Phenoxazin-3-one, 7-butoxy-
- 7-butoxyphenoxazin-3-one
- 64257-90-5
- DTXSID70802730
- SCHEMBL16069679
- 7-BUTOXY-3H-PHENOXAZIN-3-ONE
-
- Inchi: 1S/C16H15NO3/c1-2-3-8-19-12-5-7-14-16(10-12)20-15-9-11(18)4-6-13(15)17-14/h4-7,9-10H,2-3,8H2,1H3
- InChI Key: DZBDKAKIBZSCFB-UHFFFAOYSA-N
- SMILES: O(C1C=CC2=C(C=1)OC1=CC(C=CC1=N2)=O)CCCC
Computed Properties
- Exact Mass: 269.10525
- Monoisotopic Mass: 269.10519334g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 20
- Rotatable Bond Count: 4
- Complexity: 478
- 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: 2.7
- Topological Polar Surface Area: 47.9?2
Experimental Properties
- PSA: 47.89
3H-Phenoxazin-3-one, 7-butoxy- Related Literature
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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