Cas no 113864-35-0 (9-decyl-3-nitrocarbazole)
9-decyl-3-nitrocarbazole structure
Product Name:9-decyl-3-nitrocarbazole
CAS No:113864-35-0
MF:C22H28N2O2
MW:352.469925880432
CID:2611813
PubChem ID:14114855
Update Time:2025-04-21
9-decyl-3-nitrocarbazole Chemical and Physical Properties
Names and Identifiers
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- 9-decyl-3-nitrocarbazole
- DTXSID60556093
- 9-Decyl-3-nitro-9H-carbazole
- SCHEMBL18261960
- 113864-35-0
-
- Inchi： 1S/C22H28N2O2/c1-2-3-4-5-6-7-8-11-16-23-21-13-10-9-12-19(21)20-17-18(24(25)26)14-15-22(20)23/h9-10,12-15,17H,2-8,11,16H2,1H3
- InChI Key： PGLYWHJWHDVNGL-UHFFFAOYSA-N
- SMILES： [O-][N+](C1C=CC2=C(C=1)C1C=CC=CC=1N2CCCCCCCCCC)=O
Computed Properties
- Exact Mass: 352.215078140Da
- Monoisotopic Mass: 352.215078140Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 26
- Rotatable Bond Count: 9
- Complexity: 436
- 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: 7.6
- Topological Polar Surface Area: 50.8?2
9-decyl-3-nitrocarbazole Related Literature
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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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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