4,6-Dimethoxypyrimidine-5-carboxylic Acid - CAS 4319-93-1
Catalog: |
BB025362 |
Product Name: |
4,6-Dimethoxypyrimidine-5-carboxylic Acid |
CAS: |
4319-93-1 |
Synonyms: |
4,6-dimethoxy-5-pyrimidinecarboxylic acid; 4,6-dimethoxypyrimidine-5-carboxylic acid |
IUPAC Name: | 4,6-dimethoxypyrimidine-5-carboxylic acid |
Description: | 4,6-Dimethoxypyrimidine-5-carboxylic Acid (CAS# 4319-93-1) is a useful research chemical. |
Molecular Weight: | 184.15 |
Molecular Formula: | C7H8N2O4 |
Canonical SMILES: | COC1=C(C(=NC=N1)OC)C(=O)O |
InChI: | InChI=1S/C7H8N2O4/c1-12-5-4(7(10)11)6(13-2)9-3-8-5/h3H,1-2H3,(H,10,11) |
InChI Key: | SOUWJIUOLGPWJL-UHFFFAOYSA-N |
LogP: | 0.19200 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-110028502-B | Preparation method of kinase inhibitor drug intermediate | 20190529 |
AU-2018360857-A1 | Modulators of the integrated stress pathway | 20171102 |
CA-3080806-A1 | Modulators of the integrated stress pathway | 20171102 |
TW-201927756-A | Integrating stress pathway regulator | 20171102 |
WO-2019090076-A1 | Modulators of the integrated stress pathway | 20171102 |
Complexity: | 175 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 184.04840674 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 184.04840674 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 81.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.3 |
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