Cas no 106273-86-3 (1-tert-butyl-3,5-dimethyl-2-nitrobenzene)
106273-86-3 structure
Product Name:1-tert-butyl-3,5-dimethyl-2-nitrobenzene
CAS No:106273-86-3
MF:C12H17NO2
MW:207.268883466721
CID:1174014
PubChem ID:19743313
Update Time:2025-04-20
1-tert-butyl-3,5-dimethyl-2-nitrobenzene Chemical and Physical Properties
Names and Identifiers
-
- 1-tert-butyl-3,5-dimethyl-2-nitrobenzene
- SureCN4913846
- 3-nitro-2,6-dimethyl-4- tert-butyl benzene
- 4-Nitro-1,3-dimethyl-5-tert.-butyl-benzol
- Benzene, 1-(1,1-dimethylethyl)-3,5-dimethyl-2-nitro-
- 3-nitro-2,6-dimethyl-4-tert-butyl benzene
- CTK0G3516
- 1-tert-butyl-3,5-dimethyl-2-nitro-benzene
- ACMC-20m9yd
- 1-tert-Butyl-3,5-dimethyl-2-nitro-benzol
- SureCN4913846; 3-nitro-2,6-dimethyl-4- tert-butyl benzene; 4-Nitro-1,3-dimethyl-5-tert.-butyl-benzol; Benzene, 1-(1,1-dimethylethyl)-3,5-dimethyl-2-nitro-; 3-nitro-2,6-dimethyl-4-tert-butyl benzene; CTK0G3516; 1-tert-butyl-3,5-dimethyl-2-nitro-benzene; ACMC-20m9yd; 1-tert-Butyl-3,5-dimethyl-2-nitro-benzol;
- DTXSID30599477
- SCHEMBL4913846
- 106273-86-3
-
- Inchi： 1S/C12H17NO2/c1-8-6-9(2)11(13(14)15)10(7-8)12(3,4)5/h6-7H,1-5H3
- InChI Key： MAXOFIZMGUQLFG-UHFFFAOYSA-N
- SMILES： [O-][N+](C1C(C)=CC(C)=CC=1C(C)(C)C)=O
Computed Properties
- Exact Mass: 207.12601
- Monoisotopic Mass: 207.125928785g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 1
- Complexity: 239
- 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: 4.2
- Topological Polar Surface Area: 45.8?2
Experimental Properties
- PSA: 43.14
1-tert-butyl-3,5-dimethyl-2-nitrobenzene Related Literature
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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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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
106273-86-3 (1-tert-butyl-3,5-dimethyl-2-nitrobenzene) Related Products
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- 6526-72-3(2-Nitrocumene)
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