Cas no 38896-06-9 (Benzene, 1-(1-ethylpropyl)-4-nitro-)
38896-06-9 structure
Product Name:Benzene, 1-(1-ethylpropyl)-4-nitro-
CAS No:38896-06-9
MF:C11H15NO2
MW:193.242303133011
CID:2825257
PubChem ID:12194992
Update Time:2025-04-21
Benzene, 1-(1-ethylpropyl)-4-nitro- Chemical and Physical Properties
Names and Identifiers
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- DTXSID80479957
- DTXCID00430767
- SCHEMBL19928087
- Benzene, 1-(1-ethylpropyl)-4-nitro-
- 38896-06-9
-
- Inchi： 1S/C11H15NO2/c1-3-9(4-2)10-5-7-11(8-6-10)12(13)14/h5-9H,3-4H2,1-2H3
- InChI Key： GAZQCCDSGQTQLZ-UHFFFAOYSA-N
- SMILES： [O-][N+](C1C=CC(=CC=1)C(CC)CC)=O
Computed Properties
- Exact Mass: 193.110278721Da
- Monoisotopic Mass: 193.110278721Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 3
- Complexity: 176
- 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: 4.5
- Topological Polar Surface Area: 45.8?2
Benzene, 1-(1-ethylpropyl)-4-nitro- Related Literature
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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