Cas no 25230-59-5 (methyl 2-formylpyridine-3-carboxylate)

methyl 2-formylpyridine-3-carboxylate structure
25230-59-5 structure
Product Name:methyl 2-formylpyridine-3-carboxylate
CAS No:25230-59-5
MF:C8H7NO3
MW:165.146082162857
MDL:MFCD11052321
CID:851446
PubChem ID:14032359
Update Time:2025-04-19

methyl 2-formylpyridine-3-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Methyl 2-formylnicotinate
    • 3-Pyridinecarboxylic acid, 2-formyl-, methyl ester
    • 2-Formyl-3-carboxymethyl-pyridin
    • 2-formylnicotinic acid methyl ester
    • 2-formyl-nicotinic acid methyl ester
    • 2-Formyl-pyridin-3-carbonsaeure-methylester
    • AG-L-22686
    • AGN-PC-0006YF
    • Ambpe2042046
    • CTK4F5252
    • SBB087882
    • methyl 2-formylpyridine-3-carboxylate
    • AKOS006308928
    • MFCD11052321
    • Methyl2-formylnicotinate
    • EN300-220291
    • DB-109213
    • DTXSID30554728
    • CS-0215082
    • Z1198309070
    • SCHEMBL4556787
    • 25230-59-5
    • E84379
    • SB54605
    • MDL： MFCD11052321
    • Inchi： 1S/C8H7NO3/c1-12-8(11)6-3-2-4-9-7(6)5-10/h2-5H,1H3
    • InChI Key： SPCNFHHJOBSFFV-UHFFFAOYSA-N
    • SMILES： O(C)C(C1=CC=CN=C1C=O)=O

Computed Properties

  • Exact Mass: 165.04261
  • Monoisotopic Mass: 165.042593085g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 3
  • Complexity: 181
  • 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: 0.5
  • Topological Polar Surface Area: 56.3?2

Experimental Properties

  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 272.3±25.0 °C at 760 mmHg
  • Flash Point: 118.5±23.2 °C
  • PSA: 56.26
  • LogP: 0.68070
  • Vapor Pressure: 0.0±0.6 mmHg at 25°C

methyl 2-formylpyridine-3-carboxylate Security Information

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