2-Ethyl-4(3H)-pyrimidinone - CAS 14331-50-1
Catalog: |
BB009550 |
Product Name: |
2-Ethyl-4(3H)-pyrimidinone |
CAS: |
14331-50-1 |
Synonyms: |
2-ethyl-1H-pyrimidin-6-one; 2-ethyl-1H-pyrimidin-6-one |
IUPAC Name: | 2-ethyl-1H-pyrimidin-6-one |
Description: | 2-Ethyl-4(3H)-pyrimidinone (CAS# 14331-50-1) is a useful research chemical. |
Molecular Weight: | 124.14 |
Molecular Formula: | C6H8N2O |
Canonical SMILES: | CCC1=NC=CC(=O)N1 |
InChI: | InChI=1S/C6H8N2O/c1-2-5-7-4-3-6(9)8-5/h3-4H,2H2,1H3,(H,7,8,9) |
InChI Key: | OFPWIXYGAJDWPC-UHFFFAOYSA-N |
Density: | 1.16 g/cm3 |
LogP: | 0.33230 |
Publication Number | Title | Priority Date |
CN-108395408-A | A kind of pharmaceutical intermediate and preparation method thereof | 20180323 |
CN-106008362-A | Preparation method of novel pyrimidine derivative | 20160524 |
CN-106008362-B | A kind of preparation method of pyrimidine derivatives | 20160524 |
WO-2017168137-A1 | Pyrimidobenzimidazoles for use in the treatment and prevention of neurodegenerative disorders | 20160329 |
CA-2979222-A1 | Triazolyl pyrimidinone compounds as pde2 inhibitors | 20150317 |
Complexity: | 182 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 124.063662883 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 124.063662883 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 41.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.1 |
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