| CAS Number | 915921-77-6 |
| Catalog Number | AG006TEL(AGN-PC-0WB3RT) |
| Chemical Name | N-(5-formylpyrimidin-2-yl)-N-methylglycine |
| IUPAC Name | 2-[(5-formylpyrimidin-2-yl)-methylamino]acetic acid |
| InChI | InChI=1S/C8H9N3O3/c1-11(4-7(13)14)8-9-2-6(5-12)3-10-8/h2-3,5H,4H2,1H3,(H,13,14) |
| InChI Key | VSXMBPJXDSWBFQ-UHFFFAOYSA-N |
| MDL Number | MFCD08752994 |
| Molecular Formula | C8H9N3O3 |
| Molecular Weight | 195.1754 |
| SMILES | C1(N(C)CC(O)=O)N=CC(=CN=1)C=O |
| Synonyms | 915921-77-6,
N-(5-FORMYLPYRIMIDIN-2-YL)-N-METHYLGLYCINE,
2-((5-Formylpyrimidin-2-yl)(methyl)amino)acetic acid,
2-[(5-formylpyrimidin-2-yl)(methyl)amino]acetic acid,
ASISCHEM C63636,
CTK5G9999,
DTXSID80589787,
ZINC8731046,
ZX-CM005316,
MFCD08752994,
AKOS000284023,
AJ-59122,
N-(5-Formyl-2-pyrimidinyl)-N-methylglycine,
Y-4700,
ASISCHEMC63636,
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| Complexity | 214 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 195.064g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 195.178g/mol |
| Monoisotopic Mass | 195.064g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 83.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.3 |
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Certificate of Analysis
Lot Number