Ethyl 4-Pyrimidinecarboxylate - CAS 62846-82-6
Catalog: |
BB031840 |
Product Name: |
Ethyl 4-Pyrimidinecarboxylate |
CAS: |
62846-82-6 |
Synonyms: |
4-pyrimidinecarboxylic acid ethyl ester; ethyl pyrimidine-4-carboxylate |
IUPAC Name: | ethyl pyrimidine-4-carboxylate |
Description: | Ethyl 4-Pyrimidinecarboxylate (CAS# 62846-82-6) is a useful research chemical. |
Molecular Weight: | 152.15 |
Molecular Formula: | C7H8N2O2 |
Canonical SMILES: | CCOC(=O)C1=NC=NC=C1 |
InChI: | InChI=1S/C7H8N2O2/c1-2-11-7(10)6-3-4-8-5-9-6/h3-5H,2H2,1H3 |
InChI Key: | DWRWSNAREGLUHZ-UHFFFAOYSA-N |
Boiling Point: | 240 °C |
Density: | 1.167 g/cm3 |
Solubility: | Other solvents(Soluble) : Methanol |
MDL: | MFCD09832999 |
LogP: | 0.65330 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112876482-A | Polysubstituted heterocyclic derivative, preparation method and medical application thereof | 20201231 |
WO-2021210586-A1 | Condensed heterocyclic compound | 20200414 |
EP-3875452-A1 | Monoacylglycerol lipase inhibitors | 20200304 |
WO-2021175913-A1 | Monoacylglycerol lipase inhibitors | 20200304 |
CN-110615792-A | 2-benzylthio-5-methyl-4, 7-dihydro- [1,2,4] triazolo [1,5-a ] pyrimidine derivatives | 20191101 |
Complexity: | 138 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 152.058577502 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 152.058577502 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 52.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.1 |
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