Cas no 23723-24-2 (3-Pyridinecarboxylicacid, 5-fluoro-, 1-methylethyl ester)

3-Pyridinecarboxylicacid, 5-fluoro-, 1-methylethyl ester structure
23723-24-2 structure
Product Name:3-Pyridinecarboxylicacid, 5-fluoro-, 1-methylethyl ester
CAS No:23723-24-2
MF:C9H10FNO2
MW:183.179605960846
CID:260570
PubChem ID:211891
Update Time:2025-04-19

3-Pyridinecarboxylicacid, 5-fluoro-, 1-methylethyl ester Chemical and Physical Properties

Names and Identifiers

    • 3-Pyridinecarboxylicacid, 5-fluoro-, 1-methylethyl ester
    • propan-2-yl 5-fluoropyridine-3-carboxylate
    • 1-Methylethyl 5-fluoro-3-pyridinecarboxylate
    • 5-Fluor-nicotinsaeureisopropylester
    • 5-fluoro-nicotinic acid isopropyl ester
    • AC1L4RRX
    • AC1Q5XUV
    • AR-1K7325
    • BRN 0474224
    • Isopropyl 5-fluoronicotinate
    • Isopropyl-5-fluornicotinat
    • LS-130956
    • Nicotinic acid, 5-fluoro-, isopropyl ester
    • nicotinic acid, 5-fluoro-, isopropyl ester(8ci)
    • Nicotinic acid, 5-fluoro-, isopropyl ester (8CI)
    • 23723-24-2
    • 3-Pyridinecarboxylic acid, 5-fluoro-, 1-methylethyl ester
    • DTXSID30178387
    • Inchi: 1S/C9H10FNO2/c1-6(2)13-9(12)7-3-8(10)5-11-4-7/h3-6H,1-2H3
    • InChI Key: CHRVVWHJGOIAFG-UHFFFAOYSA-N
    • SMILES: FC1=CN=CC(=C1)C(=O)OC(C)C

Computed Properties

  • Exact Mass: 183.0696
  • Monoisotopic Mass: 183.07
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 3
  • Complexity: 185
  • 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: 1.6
  • Topological Polar Surface Area: 39.2?2

Experimental Properties

  • Density: 1.158
  • Boiling Point: 226.3°Cat760mmHg
  • Flash Point: 90.6°C
  • Refractive Index: 1.485
  • PSA: 39.19
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