Cas no 89032-19-9 (2-Pyridinecarboxylic acid, 4,6-bis(1,1-dimethylethyl)-)
89032-19-9 structure
Product Name:2-Pyridinecarboxylic acid, 4,6-bis(1,1-dimethylethyl)-
CAS No:89032-19-9
MF:C14H21NO2
MW:235.32204413414
CID:615150
PubChem ID:13244750
Update Time:2025-04-19
2-Pyridinecarboxylic acid, 4,6-bis(1,1-dimethylethyl)- Chemical and Physical Properties
Names and Identifiers
-
- 2-Pyridinecarboxylic acid, 4,6-bis(1,1-dimethylethyl)-
- 4,6-ditert-butylpyridine-2-carboxylic acid
- 4,6-Di-tert-butylpyridine-2-carboxylic acid
- 89032-19-9
- DTXSID40531545
-
- Inchi： 1S/C14H21NO2/c1-13(2,3)9-7-10(12(16)17)15-11(8-9)14(4,5)6/h7-8H,1-6H3,(H,16,17)
- InChI Key： YGGDRTHFMRSNCV-UHFFFAOYSA-N
- SMILES： OC(C1=CC(=CC(C(C)(C)C)=N1)C(C)(C)C)=O
Computed Properties
- Exact Mass: 235.157228913g/mol
- Monoisotopic Mass: 235.157228913g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 17
- Rotatable Bond Count: 3
- Complexity: 286
- 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: 4.1
- Topological Polar Surface Area: 50.2?2
2-Pyridinecarboxylic acid, 4,6-bis(1,1-dimethylethyl)- Related Literature
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
89032-19-9 (2-Pyridinecarboxylic acid, 4,6-bis(1,1-dimethylethyl)-) Related Products
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- 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)
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