Cas no 72373-70-7 (2-tert-butyl-5-methyl-4-nitrophenol)
72373-70-7 structure
Product Name:2-tert-butyl-5-methyl-4-nitrophenol
CAS No:72373-70-7
MF:C11H15NO3
MW:209.241703271866
CID:1758659
PubChem ID:51569
Update Time:2025-04-21
2-tert-butyl-5-methyl-4-nitrophenol Chemical and Physical Properties
Names and Identifiers
-
- 2-tert-butyl-5-methyl-4-nitrophenol
- phenol, 2-(1,1-dimethylethyl)-5-methyl-4-nitro-
- 3-Methyl-6-tert-butyl-4-nitrophenol
- 72373-70-7
- 6-tert-Butyl-4-nitro-m-cresol
- starbld0011157
- DB-116902
- m-CRESOL, 6-tert-BUTYL-4-NITRO-
- DTXCID50145172
- Phenol,1-dimethylethyl)-5-methyl-4-nitro-
- AKOS019823154
- NSC 78909
- NSC78909
- 3-06-00-01984 (Beilstein Handbook Reference)
- SCHEMBL17375007
- WLN: WNR DQ B1 EX1&1&1
- BRN 2112620
- 2-(tert-Butyl)-5-methyl-4-nitrophenol
- NSC-78909
- NCIOpen2_004379
- DTXSID20222681
- AKOS040752963
-
- Inchi： 1S/C11H15NO3/c1-7-5-10(13)8(11(2,3)4)6-9(7)12(14)15/h5-6,13H,1-4H3
- InChI Key： LCIFJBVMAQCODX-UHFFFAOYSA-N
- SMILES： OC1C=C(C)C(=CC=1C(C)(C)C)[N+](=O)[O-]
Computed Properties
- Exact Mass: 209.10525
- Monoisotopic Mass: 209.10519334g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 1
- Complexity: 241
- 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: 3.4
- Topological Polar Surface Area: 66?2
Experimental Properties
- PSA: 63.37
2-tert-butyl-5-methyl-4-nitrophenol Related Literature
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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Zhizhen Lai,Mo Zhang,Jinyu Zhou,Tianjing Chen,Dan Li,Xuejing Shen,Jia Liu,Jiang Zhou,Zhili Li Analyst, 2021,146, 4261-4267
72373-70-7 (2-tert-butyl-5-methyl-4-nitrophenol) Related Products
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