Cas no 62559-41-5 (Benzene, 1-ethyl-4-methyl-2-nitro-)
62559-41-5 structure
Product Name:Benzene, 1-ethyl-4-methyl-2-nitro-
CAS No:62559-41-5
MF:C9H11NO2
MW:165.189142465591
CID:440159
PubChem ID:12336086
Update Time:2025-04-19
Benzene, 1-ethyl-4-methyl-2-nitro- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 1-ethyl-4-methyl-2-nitro-
- 1-ethyl-4-methyl-2-nitrobenzene
- DTXSID30491341
- 62559-41-5
- SCHEMBL7088682
-
- Inchi： 1S/C9H11NO2/c1-3-8-5-4-7(2)6-9(8)10(11)12/h4-6H,3H2,1-2H3
- InChI Key： XJAICIFEUVONSU-UHFFFAOYSA-N
- SMILES： [O-][N+](C1C=C(C)C=CC=1CC)=O
Computed Properties
- Exact Mass: 165.07903
- Monoisotopic Mass: 165.078978594g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 164
- 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: 2.9
- Topological Polar Surface Area: 45.8?2
Experimental Properties
- PSA: 43.14
Benzene, 1-ethyl-4-methyl-2-nitro- Related Literature
-
Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
-
Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
62559-41-5 (Benzene, 1-ethyl-4-methyl-2-nitro-) Related Products
- 89-58-7(2,5-Dimethylnitrobenzene)
- 15121-84-3(2-Nitrophenethyl alcohol)
- 1817-75-0(Benzene,1-nitro-2-[(4-nitrophenyl)methyl]-)
- 611-05-2(3-Methyl-4-nitroaniline)
- 6526-72-3(2-Nitrocumene)
- 16968-19-7(2,2'-Dinitrodibenzyl)
- 163704-72-1(2,6-Diisopropyl-4-nitroaniline)
- 20191-74-6(2-Ethyl-5-nitrobenzenamine)
- 1886-57-3(1-tert-Butyl-2-nitrobenzene)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
Recommended suppliers
Shanghai Bent Chemical Co., Ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
Enjia Trading Co., Ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
Shandong Feiyang Chemical Co., Ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
Hebei Liye chemical Co.,Ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
Hangzhou TSurgeX Pharmaceutical Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Reagent
