Cas no 150017-44-0 (1,2,3-Triazine-5-carboxylicacid, 4-methyl-, methyl ester)
150017-44-0 structure
Product Name:1,2,3-Triazine-5-carboxylicacid, 4-methyl-, methyl ester
CAS No:150017-44-0
MF:C6H7N3O2
MW:153.138680696487
CID:100000
PubChem ID:45090131
Update Time:2025-04-18
1,2,3-Triazine-5-carboxylicacid, 4-methyl-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- 1,2,3-Triazine-5-carboxylicacid, 4-methyl-, methyl ester
- methyl 4-methyltriazine-5-carboxylate
- 1,2,3-Triazine-5-carboxylicacid,4-methyl-,methylester(9CI)
- Methyl 4-methyl-1,2,3-triazine-5-carboxylate
- 150017-44-0
- Methyl4-methyl-1,2,3-triazine-5-carboxylate
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- Inchi： 1S/C6H7N3O2/c1-4-5(6(10)11-2)3-7-9-8-4/h3H,1-2H3
- InChI Key： IRWMFMLEIZJUSV-UHFFFAOYSA-N
- SMILES： O(C)C(C1C=NN=NC=1C)=O
Computed Properties
- Exact Mass: 153.054
- Monoisotopic Mass: 153.054
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 151
- 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
- Topological Polar Surface Area: 65A^2
- XLogP3: -0.4
1,2,3-Triazine-5-carboxylicacid, 4-methyl-, methyl ester Related Literature
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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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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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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