Cas no 127958-04-7 (5-Pyrimidinecarboxylic acid, 2-amino-4-(1,1-dimethylethyl)- (9CI))
127958-04-7 structure
Product Name:5-Pyrimidinecarboxylic acid, 2-amino-4-(1,1-dimethylethyl)- (9CI)
CAS No:127958-04-7
MF:C9H13N3O2
MW:195.218421697617
CID:897667
Update Time:2025-04-19
5-Pyrimidinecarboxylic acid, 2-amino-4-(1,1-dimethylethyl)- (9CI) Chemical and Physical Properties
Names and Identifiers
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- 5-Pyrimidinecarboxylic acid, 2-amino-4-(1,1-dimethylethyl)- (9CI)
- 2-amino-4-tert-butylpyrimidine-5-carboxylic acid
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- Inchi： 1S/C9H13N3O2/c1-9(2,3)6-5(7(13)14)4-11-8(10)12-6/h4H,1-3H3,(H,13,14)(H2,10,11,12)
- InChI Key： BULMUPMSQNUNKD-UHFFFAOYSA-N
- SMILES： C1(N)=NC=C(C(O)=O)C(C(C)(C)C)=N1
Computed Properties
- Exact Mass: 195.10089
Experimental Properties
- PSA: 89.1
5-Pyrimidinecarboxylic acid, 2-amino-4-(1,1-dimethylethyl)- (9CI) Related Literature
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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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
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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5. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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