Cas no 159092-73-6 (Phenanthrene,3,10-dinitro-)
Phenanthrene,3,10-dinitro- structure
Product Name:Phenanthrene,3,10-dinitro-
CAS No:159092-73-6
MF:C14H8N2O4
MW:268.224323272705
CID:159432
PubChem ID:154726
Update Time:2025-04-19
Phenanthrene,3,10-dinitro- Chemical and Physical Properties
Names and Identifiers
-
- Phenanthrene,3,10-dinitro-
- 3,10-dinitrophenanthrene
- CCRIS 7656
- DTXSID40166573
- 159092-73-6
- Phenanthrene, 3,10-dinitro-
-
- Inchi： 1S/C14H8N2O4/c17-15(18)10-5-6-12-13(8-10)11-4-2-1-3-9(11)7-14(12)16(19)20/h1-8H
- InChI Key： DQBMGNWHYUFBJA-UHFFFAOYSA-N
- SMILES： [O-][N+](C1C=C2C=CC=CC2=C2C=C(C=CC2=1)[N+](=O)[O-])=O
Computed Properties
- Exact Mass: 268.04844
- Monoisotopic Mass: 268.048
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 20
- Rotatable Bond Count: 0
- Complexity: 403
- 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: 4.1
- Topological Polar Surface Area: 91.6?2
Experimental Properties
- Density: 1.3140 (rough estimate)
- Boiling Point: 411.39°C (rough estimate)
- Flash Point: 254.9°C
- Refractive Index: 1.5910 (estimate)
- PSA: 86.28
Phenanthrene,3,10-dinitro- Related Literature
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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