6-Methoxy-4-methylnicotinaldehyde - CAS 123506-66-1
Catalog: |
BB005704 |
Product Name: |
6-Methoxy-4-methylnicotinaldehyde |
CAS: |
123506-66-1 |
Synonyms: |
6-methoxy-4-methyl-3-pyridinecarboxaldehyde; 6-methoxy-4-methylpyridine-3-carbaldehyde |
IUPAC Name: | 6-methoxy-4-methylpyridine-3-carbaldehyde |
Description: | 6-Methoxy-4-methylnicotinaldehyde (CAS# 123506-66-1 ) is a useful research chemical. |
Molecular Weight: | 151.16 |
Molecular Formula: | C8H9NO2 |
Canonical SMILES: | CC1=CC(=NC=C1C=O)OC |
InChI: | InChI=1S/C8H9NO2/c1-6-3-8(11-2)9-4-7(6)5-10/h3-5H,1-2H3 |
InChI Key: | DRPZNLLEUHICFW-UHFFFAOYSA-N |
Boiling Point: | 274.173 °C at 760 mmHg |
Density: | 1.123 g/cm3 |
Storage: | Inert atmosphere, 2-8 °C |
LogP: | 1.21110 |
Publication Number | Title | Priority Date |
WO-2021076890-A1 | INHIBITING HUMAN INTEGRIN α4β7 | 20191016 |
WO-2021076902-A1 | INHIBITING HUMAN INTEGRIN α 4 β 7 | 20191016 |
US-11104661-B1 | Inhibiting human integrin (α-4) (β-7) | 20191016 |
WO-2020127508-A1 | Substituted oxopyridine derivatives | 20181221 |
US-2019315692-A1 | Antagonists of human integrin (alpha4)(beta7) | 20180412 |
Complexity: | 138 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 151.06332853 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 151.06332853 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 39.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1 |
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