Cas no 3317-72-4 (1-(2-Methylcyclopropyl)-4-nitrobenzene)
3317-72-4 structure
Product Name:1-(2-Methylcyclopropyl)-4-nitrobenzene
CAS No:3317-72-4
MF:C10H11NO2
MW:177.199842691422
CID:2856278
PubChem ID:13228158
Update Time:2025-04-21
1-(2-Methylcyclopropyl)-4-nitrobenzene Chemical and Physical Properties
Names and Identifiers
-
- DTXSID201283160
- 1-(2-methylcyclopropyl)-4-nitrobenzene
- 3317-72-4
- 1-(2-Methylcyclopropyl)-4-nitrobenzene
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- Inchi： 1S/C10H11NO2/c1-7-6-10(7)8-2-4-9(5-3-8)11(12)13/h2-5,7,10H,6H2,1H3
- InChI Key： QSUYMHNOCCEXLG-UHFFFAOYSA-N
- SMILES： [O-][N+](C1C=CC(=CC=1)C1CC1C)=O
Computed Properties
- Exact Mass: 177.078978594Da
- Monoisotopic Mass: 177.078978594Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 203
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.9
- Topological Polar Surface Area: 45.8?2
1-(2-Methylcyclopropyl)-4-nitrobenzene Related Literature
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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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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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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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