Cas no 150017-42-8 (1,2,3-Triazine-4-carboxylicacid, 5-methyl-, methyl ester)
150017-42-8 structure
Product Name:1,2,3-Triazine-4-carboxylicacid, 5-methyl-, methyl ester
CAS No:150017-42-8
MF:C6H7N3O2
MW:153.138680696487
CID:100002
PubChem ID:15152499
Update Time:2025-04-18
1,2,3-Triazine-4-carboxylicacid, 5-methyl-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- 1,2,3-Triazine-4-carboxylicacid, 5-methyl-, methyl ester
- methyl 5-methyltriazine-4-carboxylate
- 1,2,3-Triazine-4-carboxylicacid,5-methyl-,methylester(9CI)
- Methyl 5-methyl-1,2,3-triazine-4-carboxylate
- 150017-42-8
- Methyl5-methyl-1,2,3-triazine-4-carboxylate
- DTXSID60569168
-
- Inchi： 1S/C6H7N3O2/c1-4-3-7-9-8-5(4)6(10)11-2/h3H,1-2H3
- InChI Key： XWMHZBCYDDKMJA-UHFFFAOYSA-N
- SMILES： O(C)C(C1=C(C=NN=N1)C)=O
Computed Properties
- Exact Mass: 153.053826475g/mol
- Monoisotopic Mass: 153.053826475g/mol
- 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
- XLogP3: -0.1
- Topological Polar Surface Area: 65?2
1,2,3-Triazine-4-carboxylicacid, 5-methyl-, methyl ester Related Literature
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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