Cas no 66202-48-0 (1H-Pyrrole-1,2-dicarboxylicacid, 1,2-diethyl ester)

1H-Pyrrole-1,2-dicarboxylicacid, 1,2-diethyl ester structure
66202-48-0 structure
Product Name:1H-Pyrrole-1,2-dicarboxylicacid, 1,2-diethyl ester
CAS No:66202-48-0
MF:C10H13NO4
MW:211.214523077011
CID:526573
Update Time:2025-04-19

1H-Pyrrole-1,2-dicarboxylicacid, 1,2-diethyl ester Chemical and Physical Properties

Names and Identifiers

    • 1H-Pyrrole-1,2-dicarboxylicacid, 1,2-diethyl ester
    • diethyl pyrrole-1,2-dicarboxylate
    • 1,2-Bisethoxycarbonylpyrrol
    • AC1L5SXF
    • AC1Q64KX
    • AG-J-04630
    • AR-1I4330
    • CTK5C3614
    • diethyl 1h-pyrrole-1,2-dicarboxylate
    • Ethyl-1,2-pyrroldicarboxylat
    • NSC81363
    • Pyrrol-1,2-dicarbonsaeure-diaethylester
    • pyrrole-1,2-dicarboxylic acid diethyl ester
    • Inchi: 1S/C10H13NO4/c1-3-14-9(12)8-6-5-7-11(8)10(13)15-4-2/h5-7H,3-4H2,1-2H3
    • InChI Key: QRFIUUDRTXYLFU-UHFFFAOYSA-N
    • SMILES: CCOC(C1N(C(OCC)=O)C=CC=1)=O

Computed Properties

  • Exact Mass: 211.08449
  • Monoisotopic Mass: 211.084
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 5
  • Complexity: 242
  • 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

Experimental Properties

  • Density: 1.16
  • Boiling Point: 301.2°Cat760mmHg
  • Flash Point: 136°C
  • Refractive Index: 1.507
  • PSA: 57.53
  • LogP: 1.66940
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