Cas no 80776-37-0 (9H-Carbazole,9-ethyl-3,5-dinitro-)
80776-37-0 structure
Product Name:9H-Carbazole,9-ethyl-3,5-dinitro-
CAS No:80776-37-0
MF:C14H11N3O4
MW:285.254842996597
CID:732361
PubChem ID:334679
Update Time:2025-04-19
9H-Carbazole,9-ethyl-3,5-dinitro- Chemical and Physical Properties
Names and Identifiers
-
- 9H-Carbazole,9-ethyl-3,5-dinitro-
- 9-ethyl-3,5-dinitrocarbazole
- DTXSID10319155
- NSC340547
- NSC-340547
- 80776-37-0
-
- Inchi： 1S/C14H11N3O4/c1-2-15-11-7-6-9(16(18)19)8-10(11)14-12(15)4-3-5-13(14)17(20)21/h3-8H,2H2,1H3
- InChI Key： SRWHEHYLAVDVGH-UHFFFAOYSA-N
- SMILES： [O-][N+](C1=CC=CC2=C1C1C=C(C=CC=1N2CC)[N+](=O)[O-])=O
Computed Properties
- Exact Mass: 285.07495584g/mol
- Monoisotopic Mass: 285.07495584g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 21
- Rotatable Bond Count: 1
- Complexity: 433
- 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: 3.3
- Topological Polar Surface Area: 96.6?2
9H-Carbazole,9-ethyl-3,5-dinitro- Related Literature
-
Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
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M. T. Colomer,S. Díaz-Moreno,A. Tamayo,A. L. Ortiz J. Mater. Chem. C, 2018,6, 12643-12651
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Doug Ogrin,Laura H. van Poppel,Simon G. Bott,Andrew R. Barron Dalton Trans., 2004, 3689-3694
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