| CAS Number | 1460321-45-2 |
| Catalog Number | AG019F2I |
| Chemical Name | 2-[(1R)-1-hydroxyethyl]pyrimidin-5-ol |
| IUPAC Name | 2-[(1R)-1-hydroxyethyl]pyrimidin-5-ol |
| InChI | InChI=1S/C6H8N2O2/c1-4(9)6-7-2-5(10)3-8-6/h2-4,9-10H,1H3/t4-/m1/s1 |
| InChI Key | NTYOXGALQDHZEW-SCSAIBSYSA-N |
| MDL Number | MFCD28096707 |
| Molecular Formula | C6H8N2O2 |
| Molecular Weight | 140.1399 |
| SMILES | C[C@@H](O)c1ncc(O)cn1 |
| Synonyms | (R)-2-(1-hydroxyethyl)pyrimidin-5-ol,
1460321-45-2,
ZINC96361371,
CS-0059960,
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| Complexity | 102 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 140.059g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 140.142g/mol |
| Monoisotopic Mass | 140.059g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 66.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.6 |
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Certificate of Analysis
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