Cas no 395099-41-9 (1H-Indazole, 3-[4-(1-methylethyl)phenyl]-5-nitro-)
![1H-Indazole, 3-[4-(1-methylethyl)phenyl]-5-nitro- structure](https://ossimg.kuujia.com/scimg/395500/395099-41-9x500.png)
395099-41-9 structure
Product Name:1H-Indazole, 3-[4-(1-methylethyl)phenyl]-5-nitro-
CAS No:395099-41-9
MF:C16H15N3O2
MW:281.309203386307
CID:1508842
Update Time:2024-08-24
1H-Indazole, 3-[4-(1-methylethyl)phenyl]-5-nitro- Chemical and Physical Properties
Names and Identifiers
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- 1H-Indazole, 3-[4-(1-methylethyl)phenyl]-5-nitro-
-
- Inchi： 1S/C16H15N3O2/c1-10(2)11-3-5-12(6-4-11)16-14-9-13(19(20)21)7-8-15(14)17-18-16/h3-10H,1-2H3,(H,17,18)
- InChI Key： NFUVDBGPWPICMC-UHFFFAOYSA-N
- SMILES： N1C2=C(C=C([N+]([O-])=O)C=C2)C(C2=CC=C(C(C)C)C=C2)=N1
Computed Properties
- Exact Mass: 281.11655
Experimental Properties
- Density: 1.265±0.06 g/cm3(Predicted)
- Boiling Point: 489.3±33.0 °C(Predicted)
- PSA: 71.82
- pka: 11.34±0.40(Predicted)
1H-Indazole, 3-[4-(1-methylethyl)phenyl]-5-nitro- Related Literature
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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