Cas no 142729-98-4 (methyl 4-cyanopyridine-2-carboxylate)

methyl 4-cyanopyridine-2-carboxylate structure
142729-98-4 structure
Product Name:methyl 4-cyanopyridine-2-carboxylate
CAS No:142729-98-4
MF:C8H6N2O2
MW:162.145441532135
MDL:MFCD14582015
CID:100965
PubChem ID:24786824
Update Time:2025-04-18

methyl 4-cyanopyridine-2-carboxylate Chemical and Physical Properties

Names and Identifiers

    • 4-cyano-2-Pyridinecarboxylic acid methyl ester
    • 2-Pyridinecarboxylicacid, 4-cyano-, methyl ester
    • METHYL 4-CYANOPYRIDINE-2-CARBOXYLATE
    • AKOS027325390
    • SCHEMBL2173326
    • 2-Pyridinecarboxylicacid,4-cyano-,methylester(9CI)
    • FNYBXMRPDDEITK-UHFFFAOYSA-N
    • Z1255452105
    • 142729-98-4
    • methyl 4-cyanopicolinate
    • 2-Pyridinecarboxylic acid, 4-cyano-, methyl ester
    • SB54406
    • AS-41168
    • CS-0188134
    • MFCD14582015
    • methyl4-cyanopicolinate
    • EN300-195174
    • methyl 4-cyanopyridine-2-carboxylate
    • MDL: MFCD14582015
    • Inchi: 1S/C8H6N2O2/c1-12-8(11)7-4-6(5-9)2-3-10-7/h2-4H,1H3
    • InChI Key: FNYBXMRPDDEITK-UHFFFAOYSA-N
    • SMILES: O(C)C(C1C=C(C#N)C=CN=1)=O

Computed Properties

  • Exact Mass: 162.043
  • Monoisotopic Mass: 162.043
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 218
  • 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
  • Topological Polar Surface Area: 63A^2
  • XLogP3: 0.8

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