Cas no 6286-10-8 (2-methoxyethyl Pyridine-4-carboxylate)

2-methoxyethyl Pyridine-4-carboxylate structure
6286-10-8 structure
Product Name:2-methoxyethyl Pyridine-4-carboxylate
CAS No:6286-10-8
MF:C9H11NO3
MW:181.188542604446
CID:958109
PubChem ID:222926
Update Time:2025-04-19

2-methoxyethyl Pyridine-4-carboxylate Chemical and Physical Properties

Names and Identifiers

    • 2-methoxyethyl Pyridine-4-carboxylate
    • NSC10011; AC1L5C69; AC1Q688R; CTK5B6373; 2-methoxyethylpyridine-4-carboxylate; AR-1E3213; NSC-10011; AG-K-91137;
    • NSC10011
    • SCHEMBL14919008
    • 6286-10-8
    • DTXSID50278772
    • NSC-10011
    • 2-methoxyethylpyridine-4-carboxylate
    • Inchi: 1S/C9H11NO3/c1-12-6-7-13-9(11)8-2-4-10-5-3-8/h2-5H,6-7H2,1H3
    • InChI Key: PFKLSZYWEGFDDJ-UHFFFAOYSA-N
    • SMILES: O(C(C1C=CN=CC=1)=O)CCOC

Computed Properties

  • Exact Mass: 181.07393
  • Monoisotopic Mass: 181.074
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 5
  • Complexity: 155
  • 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: 0.9
  • Topological Polar Surface Area: 48.4?2

Experimental Properties

  • Density: 1.132
  • Boiling Point: 240.2°C at 760 mmHg
  • Flash Point: 99.1°C
  • Refractive Index: 1.501
  • PSA: 48.42
  • LogP: 0.88480
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