Cas no 179898-86-3 (Quinoline, 1,2,3,4-tetrahydro-3,3-dimethyl-7-nitro-)
179898-86-3 structure
Product Name:Quinoline, 1,2,3,4-tetrahydro-3,3-dimethyl-7-nitro-
CAS No:179898-86-3
MF:C11H14N2O2
MW:206.241062641144
CID:1370690
Update Time:2024-08-16
Quinoline, 1,2,3,4-tetrahydro-3,3-dimethyl-7-nitro- Chemical and Physical Properties
Names and Identifiers
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- Quinoline, 1,2,3,4-tetrahydro-3,3-dimethyl-7-nitro-
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- Inchi： 1S/C11H14N2O2/c1-11(2)6-8-3-4-9(13(14)15)5-10(8)12-7-11/h3-5,12H,6-7H2,1-2H3
- InChI Key： ATHOUIIZDUZMNO-UHFFFAOYSA-N
- SMILES： N1C2=C(C=CC([N+]([O-])=O)=C2)CC(C)(C)C1
Computed Properties
- Exact Mass: 206.10562
Experimental Properties
- Density: 1.129±0.06 g/cm3(Predicted)
- Boiling Point: 324.7±31.0 °C(Predicted)
- PSA: 55.17
- pka: 3.52±0.40(Predicted)
Quinoline, 1,2,3,4-tetrahydro-3,3-dimethyl-7-nitro- Related Literature
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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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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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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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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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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