Cas no 168897-56-1 (Isoquinoline, 1,2,3,4-tetrahydro-2-[(3-nitrophenyl)methyl]-)
![Isoquinoline, 1,2,3,4-tetrahydro-2-[(3-nitrophenyl)methyl]- structure](https://ossimg.kuujia.com/scimg/169000/168897-56-1x500.png)
168897-56-1 structure
Product Name:Isoquinoline, 1,2,3,4-tetrahydro-2-[(3-nitrophenyl)methyl]-
CAS No:168897-56-1
MF:C16H16N2O2
MW:268.310443878174
CID:1350832
Update Time:2024-08-17
Isoquinoline, 1,2,3,4-tetrahydro-2-[(3-nitrophenyl)methyl]- Chemical and Physical Properties
Names and Identifiers
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- Isoquinoline, 1,2,3,4-tetrahydro-2-[(3-nitrophenyl)methyl]-
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- Inchi： 1S/C16H16N2O2/c19-18(20)16-7-3-4-13(10-16)11-17-9-8-14-5-1-2-6-15(14)12-17/h1-7,10H,8-9,11-12H2
- InChI Key： QBJNCUIXIUYYKO-UHFFFAOYSA-N
- SMILES： C1C2=C(C=CC=C2)CCN1CC1=CC=CC([N+]([O-])=O)=C1
Computed Properties
- Exact Mass: 268.12128
Experimental Properties
- Density: 1.233±0.06 g/cm3(Predicted)
- Boiling Point: 415.0±35.0 °C(Predicted)
- PSA: 46.38
- pka: 7.22±0.20(Predicted)
Isoquinoline, 1,2,3,4-tetrahydro-2-[(3-nitrophenyl)methyl]- Related Literature
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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