Cas no 1211531-94-0 (6-methoxy-5-methylpyridine-3-carboxylic acid)

6-methoxy-5-methylpyridine-3-carboxylic acid structure
1211531-94-0 structure
Product Name:6-methoxy-5-methylpyridine-3-carboxylic acid
CAS No:1211531-94-0
MF:C8H9NO3
MW:167.161962270737
MDL:MFCD16295277
CID:1083422
PubChem ID:68639649
Update Time:2025-04-20

6-methoxy-5-methylpyridine-3-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 6-Methoxy-5-methylnicotinic acid
    • 6-methoxy-5-methylpyridine-3-carboxylic acid
    • EN300-1846175
    • A891908
    • AKOS022181514
    • DA-36064
    • 1211531-94-0
    • DTXSID20738717
    • AS-39704
    • 6-Methoxy-5-Methyl-nicotinic acid
    • SCHEMBL3430654
    • 6-methoxy-5-methylnicotinicacid
    • MFCD16295277
    • CS-0036768
    • AB70810
    • MDL： MFCD16295277
    • Inchi： 1S/C8H9NO3/c1-5-3-6(8(10)11)4-9-7(5)12-2/h3-4H,1-2H3,(H,10,11)
    • InChI Key： XJXUPIMYYIFYBX-UHFFFAOYSA-N
    • SMILES： O(C)C1C(C)=CC(C(=O)O)=CN=1

Computed Properties

  • Exact Mass: 167.058243149g/mol
  • Monoisotopic Mass: 167.058243149g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 172
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1
  • Topological Polar Surface Area: 59.4?2

Experimental Properties

  • Density: 1.233±0.06 g/cm3 (20 oC 760 Torr),
  • Boiling Point: 292.8±35.0 oC (760 Torr),
  • Flash Point: 130.9±25.9 oC,
  • Solubility: Slightly soluble (9.7 g/l) (25 o C),

6-methoxy-5-methylpyridine-3-carboxylic acid Pricemore >>

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