8-methoxy-2-methyl-1-oxo-1,2-dihydroisoquinoline-3-carbaldehyde - CAS 887574-65-4
Catalog: |
BB039178 |
Product Name: |
8-methoxy-2-methyl-1-oxo-1,2-dihydroisoquinoline-3-carbaldehyde |
CAS: |
887574-65-4 |
Synonyms: |
8-methoxy-2-methyl-1-oxo-3-isoquinolinecarboxaldehyde; 8-methoxy-2-methyl-1-oxoisoquinoline-3-carbaldehyde |
IUPAC Name: | 8-methoxy-2-methyl-1-oxoisoquinoline-3-carbaldehyde |
Description: | 8-methoxy-2-methyl-1-oxo-1,2-dihydroisoquinoline-3-carbaldehyde (CAS# 887574-65-4 ) is a useful research chemical. |
Molecular Weight: | 217.224 |
Molecular Formula: | C12H11NO3 |
Canonical SMILES: | CN1C(=CC2=C(C1=O)C(=CC=C2)OC)C=O |
InChI: | InChI=1S/C12H11NO3/c1-13-9(7-14)6-8-4-3-5-10(16-2)11(8)12(13)15/h3-7H,1-2H3 |
InChI Key: | YONMQOLIFYCWOS-UHFFFAOYSA-N |
Complexity: | 337 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 217.07389321 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 217.07389321 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 46.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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