Cas no 81316-88-3 (7-nitrobenzo[ghi]perylene)
![7-nitrobenzo[ghi]perylene structure](https://ossimg.kuujia.com/scimg/81500/81316-88-3x500.png)
7-nitrobenzo[ghi]perylene structure
Product Name:7-nitrobenzo[ghi]perylene
CAS No:81316-88-3
MF:C22H11NO2
MW:321.328245401382
CID:1802911
PubChem ID:149916
Update Time:2025-04-21
7-nitrobenzo[ghi]perylene Chemical and Physical Properties
Names and Identifiers
-
- 7-nitrobenzo[ghi]perylene
- Benzo(ghi)perylene, 7-nitro-
- QCFGYKUPIIYMMJ-UHFFFAOYSA-N
- 7-nitrobenzo(ghi)perylene
- DTXSID20231051
- 7-Nitrobenzo[ghi]perylene #
- 81316-88-3
-
- Inchi： 1S/C22H11NO2/c24-23(25)17-11-10-15-9-8-14-7-6-13-5-4-12-2-1-3-16-18(12)19(13)20(14)21(15)22(16)17/h1-11H
- InChI Key： QCFGYKUPIIYMMJ-UHFFFAOYSA-N
- SMILES： [O-][N+](C1C=CC2=CC=C3C=CC4C=CC5=CC=CC6C=1C2=C3C=4C=65)=O
Computed Properties
- Exact Mass: 321.078978594g/mol
- Monoisotopic Mass: 321.078978594g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 25
- Rotatable Bond Count: 0
- Complexity: 571
- 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: 6.5
- Topological Polar Surface Area: 45.8?2
7-nitrobenzo[ghi]perylene Related Literature
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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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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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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