Cas no 81803-59-0 (2-Propenoic acid, 2-azido-3-(2-pyridinyl)-, ethyl ester)

2-Propenoic acid, 2-azido-3-(2-pyridinyl)-, ethyl ester structure
81803-59-0 structure
Product Name:2-Propenoic acid, 2-azido-3-(2-pyridinyl)-, ethyl ester
CAS No:81803-59-0
MF:C10H10N4O2
MW:218.2120013237
CID:702920
PubChem ID:13639200
Update Time:2025-04-19

2-Propenoic acid, 2-azido-3-(2-pyridinyl)-, ethyl ester Chemical and Physical Properties

Names and Identifiers

    • 2-Propenoic acid, 2-azido-3-(2-pyridinyl)-, ethyl ester
    • ethyl 2-azido-3-pyridin-2-ylprop-2-enoate
    • A898126
    • 81803-59-0
    • SCHEMBL13904697
    • Inchi: 1S/C10H10N4O2/c1-2-16-10(15)9(13-14-11)7-8-5-3-4-6-12-8/h3-7H,2H2,1H3/b9-7-
    • InChI Key: RGTWREOOVYIPNN-CLFYSBASSA-N
    • SMILES: O(C(/C(=C/C1C=CC=CN=1)/N=[N+]=[N-])=O)CC

Computed Properties

  • Exact Mass: 218.08037557g/mol
  • Monoisotopic Mass: 218.08037557g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 5
  • Complexity: 321
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.7
  • Topological Polar Surface Area: 53.6?2

Experimental Properties

  • Melting Point: 36-38 oC (ethyl ether )

2-Propenoic acid, 2-azido-3-(2-pyridinyl)-, ethyl ester Related Literature

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