2-[(Tetrahydro-2H-pyran-4-yl)oxy]-3-pyridinecarboxaldehyde - CAS 1987013-92-2
Catalog: |
BB057018 |
Product Name: |
2-[(Tetrahydro-2H-pyran-4-yl)oxy]-3-pyridinecarboxaldehyde |
CAS: |
1987013-92-2 |
Synonyms: |
2-((Tetrahydro-2H-pyran-4-yl)oxy)nicotinaldehyde; 2-(Tetrahydro-pyran-4-yloxy)-pyridine-3-carbaldehyde |
IUPAC Name: | 2-(oxan-4-yloxy)pyridine-3-carbaldehyde |
Description: | 2-[(Tetrahydro-2H-pyran-4-yl)oxy]-3-pyridinecarboxaldehyde, is a building block used in the synthesis of various chemical compounds. |
Molecular Weight: | 207.23 |
Molecular Formula: | C11H13NO3 |
Canonical SMILES: | C1COCCC1OC2=C(C=CC=N2)C=O |
InChI: | InChI=1S/C11H13NO3/c13-8-9-2-1-5-12-11(9)15-10-3-6-14-7-4-10/h1-2,5,8,10H,3-4,6-7H2 |
InChI Key: | IOMOINYTCFFBHW-UHFFFAOYSA-N |
Complexity: | 204 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 207.08954328 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 207.08954328 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 48.4Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1 |
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