Methyl 4-Hydroxypyrimidine-5-carboxylate - CAS 4774-35-0
Catalog: |
BB026384 |
Product Name: |
Methyl 4-Hydroxypyrimidine-5-carboxylate |
CAS: |
4774-35-0 |
Synonyms: |
6-oxo-1H-pyrimidine-5-carboxylic acid methyl ester; methyl 6-oxo-1H-pyrimidine-5-carboxylate |
IUPAC Name: | methyl 6-oxo-1H-pyrimidine-5-carboxylate |
Description: | Methyl 4-Hydroxypyrimidine-5-carboxylate (CAS# 4774-35-0) is a useful research chemical. |
Molecular Weight: | 154.12 |
Molecular Formula: | C6H6N2O3 |
Canonical SMILES: | COC(=O)C1=CN=CNC1=O |
InChI: | InChI=1S/C6H6N2O3/c1-11-6(10)4-2-7-3-8-5(4)9/h2-3H,1H3,(H,7,8,9) |
InChI Key: | KFWOVXLWAGKILN-UHFFFAOYSA-N |
Boiling Point: | 256.9 ℃ at 760 mmHg |
Density: | 1.399 g/cm3 |
MDL: | MFCD01632117 |
LogP: | -0.03120 |
Publication Number | Title | Priority Date |
WO-2021197276-A1 | Amide compounds and uses thereof | 20200330 |
US-2013210832-A1 | 1h-imidazo[4,5-c]quinolines | 20100517 |
US-8895581-B2 | 1H-imidazo[4,5-c]quinolines | 20100517 |
WO-2011144622-A1 | 1h - imidazo [4, 5 - c] quinolines | 20100517 |
EP-2560967-B1 | Heterocyclic carboxylic acid amides as PDK1 inihibitors | 20100421 |
Complexity: | 255 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 154.03784206 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 154.03784206 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 67.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.6 |
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