Cas no 4162-89-4 (5-tert-butyl-2-methyl-1,3-dinitrobenzene)
4162-89-4 structure
Product Name:5-tert-butyl-2-methyl-1,3-dinitrobenzene
CAS No:4162-89-4
MF:C11H14N2O4
MW:238.239862918854
CID:927170
PubChem ID:232440
Update Time:2025-04-19
5-tert-butyl-2-methyl-1,3-dinitrobenzene Chemical and Physical Properties
Names and Identifiers
-
- 5-tert-butyl-2-methyl-1,3-dinitrobenzene
- 4-(tert-butyl)-2,6-dinitrotoluene
- 4-tert-butyl-2,6-dinitrotoluene
- 5-tert-butyl-2-methyl-1,3-dinitro-benzene
- 5-tert-Butyl-2-methyl-1,3-dinitro-benzol
- AC1L5NVT
- AC1Q5AIR
- AR-1G9510
- CTK1D8346
- NSC29875
- Oprea1_298003
- 4162-89-4
- DTXSID80283117
- DS-013426
- AKOS002783910
- SCHEMBL10385745
- NSC-29875
- 2-methyl-1,3-dinitro-5-tert-butyl-benzene
-
- Inchi： 1S/C11H14N2O4/c1-7-9(12(14)15)5-8(11(2,3)4)6-10(7)13(16)17/h5-6H,1-4H3
- InChI Key： WOVNZYUOPUALPT-UHFFFAOYSA-N
- SMILES： [O-][N+](C1C(C)=C(C=C(C=1)C(C)(C)C)[N+](=O)[O-])=O
Computed Properties
- Exact Mass: 238.09542
- Monoisotopic Mass: 238.095
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 17
- Rotatable Bond Count: 1
- Complexity: 289
- 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: 3.6
- Topological Polar Surface Area: 91.6?2
Experimental Properties
- Density: 1.215
- Boiling Point: 297.8°C at 760 mmHg
- Flash Point: 119.2°C
- Refractive Index: 1.55
- PSA: 86.28
- LogP: 4.15530
5-tert-butyl-2-methyl-1,3-dinitrobenzene Related Literature
-
Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
-
Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
-
Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
-
Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
4162-89-4 (5-tert-butyl-2-methyl-1,3-dinitrobenzene) Related Products
- 3463-35-2(2,5-Di-tert-butylnitrobenzene)
- 1204-29-1(1-Ethyl-2,4-dinitrobenzene)
- 6526-72-3(2-Nitrocumene)
- 1886-57-3(1-tert-Butyl-2-nitrobenzene)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
Recommended suppliers
PRIBOLAB PTE.LTD
Gold Member
Audited Supplier
CN Supplier
Reagent
Shanghai Aoguang Biotechnology Co., Ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
Zhejiang Brunova Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
煙臺(tái)朗裕新材料科技有限公司
Gold Member
Audited Supplier
CN Supplier
Reagent
SHOCHEM(SHANGHAI) CO.,lTD
Gold Member
Audited Supplier
CN Supplier
Bulk
