| CAS Number | 948594-77-2 |
| Catalog Number | AG00IIMD |
| Chemical Name | Methyl 2-(5-hydroxypyrimidin-2-yl)acetate |
| IUPAC Name | methyl 2-(5-hydroxypyrimidin-2-yl)acetate |
| InChI | InChI=1S/C7H8N2O3/c1-12-7(11)2-6-8-3-5(10)4-9-6/h3-4,10H,2H2,1H3 |
| InChI Key | GOXXFOVXAUYLPR-UHFFFAOYSA-N |
| MDL Number | MFCD16987769 |
| Molecular Formula | C7H8N2O3 |
| Molecular Weight | 168.1500 |
| SMILES | COC(=O)CC1=NC=C(C=N1)O |
| Synonyms | METHYL 2-(5-HYDROXYPYRIMIDIN-2-YL)ACETATE,
948594-77-2,
SCHEMBL4206723,
CTK8E6003,
GOXXFOVXAUYLPR-UHFFFAOYSA-N,
MFCD16987769,
ZINC59099984,
AKOS015968447,
FCH1178550,
AM806257,
AS-39717,
TX-017697,
CS-0037240,
5-Hydroxypyrimidine-2-acetic acid methyl ester,
2-Pyrimidineacetic acid, 5-hydroxy-, methyl ester,
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| Complexity | 155 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 168.053g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 168.152g/mol |
| Monoisotopic Mass | 168.053g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 72.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number