2-Cyclobutoxypyrimidine-5-carbaldehyde - CAS 1192569-95-1
Catalog: |
BB004446 |
Product Name: |
2-Cyclobutoxypyrimidine-5-carbaldehyde |
CAS: |
1192569-95-1 |
Synonyms: |
2-cyclobutyloxy-5-pyrimidinecarboxaldehyde; 2-cyclobutyloxypyrimidine-5-carbaldehyde |
IUPAC Name: | 2-cyclobutyloxypyrimidine-5-carbaldehyde |
Description: | 2-Cyclobutoxypyrimidine-5-carbaldehyde (CAS# 1192569-95-1 ) is a useful research chemical. |
Molecular Weight: | 178.19 |
Molecular Formula: | C9H10N2O2 |
Canonical SMILES: | C1CC(C1)OC2=NC=C(C=N2)C=O |
InChI: | InChI=1S/C9H10N2O2/c12-6-7-4-10-9(11-5-7)13-8-2-1-3-8/h4-6,8H,1-3H2 |
InChI Key: | YIHPGYWWLUWZBA-UHFFFAOYSA-N |
LogP: | 1.22040 |
Publication Number | Title | Priority Date |
US-2011092481-A1 | Quinoline or isoquinoline substituted p2x7 antagonists | 20080422 |
US-8431704-B2 | Quinoline or isoquinoline substituted P2X7 antagonists | 20080422 |
Complexity: | 175 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 178.074227566 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 178.074227566 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 52.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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