Cas no 7468-92-0 (3-bromobenzo[a]phenazin-5(7H)-one)
![3-bromobenzo[a]phenazin-5(7H)-one structure](https://ossimg.kuujia.com/scimg/7500/7468-92-0x500.png)
7468-92-0 structure
Product Name:3-bromobenzo[a]phenazin-5(7H)-one
CAS No:7468-92-0
MF:C16H9BrN2O
MW:325.159462690353
CID:979870
PubChem ID:135441712
Update Time:2025-04-19
3-bromobenzo[a]phenazin-5(7H)-one Chemical and Physical Properties
Names and Identifiers
-
- 3-bromobenzo[a]phenazin-5(7H)-one
- 3-bromo-7H-benzo[a]phenazin-5-one
- AC1L7ZGW
- NSC400582
- NSC-400582
- 7468-92-0
- DTXSID40322157
-
- Inchi： 1S/C16H9BrN2O/c17-9-5-6-10-11(7-9)15(20)8-14-16(10)19-13-4-2-1-3-12(13)18-14/h1-8,20H
- InChI Key： LVEOEMKQNYDAAJ-UHFFFAOYSA-N
- SMILES： BrC1C=CC2=C(C=1)C(=CC1C2=NC2C=CC=CC=2N=1)O
Computed Properties
- Exact Mass: 323.98987
- Monoisotopic Mass: 323.98983g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 20
- Rotatable Bond Count: 0
- Complexity: 366
- 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: 4.2
- Topological Polar Surface Area: 46?2
Experimental Properties
- PSA: 41.46
- LogP: 4.40430
3-bromobenzo[a]phenazin-5(7H)-one Related Literature
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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