Cas no 83256-18-2 ((E)-2-(2,6-dimethoxy-5-nitropyrimidin-4-yl)-N,N-dimethylethenamine)

(E)-2-(2,6-dimethoxy-5-nitropyrimidin-4-yl)-N,N-dimethylethenamine structure
83256-18-2 structure
Product Name:(E)-2-(2,6-dimethoxy-5-nitropyrimidin-4-yl)-N,N-dimethylethenamine
CAS No:83256-18-2
MF:C10H14N4O4
MW:254.242561817169
CID:1809966
PubChem ID:840521
Update Time:2025-04-21

(E)-2-(2,6-dimethoxy-5-nitropyrimidin-4-yl)-N,N-dimethylethenamine Chemical and Physical Properties

Names and Identifiers

    • (E)-2-(2,6-dimethoxy-5-nitropyrimidin-4-yl)-N,N-dimethylethenamine
    • [2-(2,6-Dimethoxy-5-nitro-pyrimidin-4-yl)-vinyl]-dimethyl-amine
    • ethenamine, 2-(2,6-dimethoxy-5-nitro-4-pyrimidinyl)-N,N-dimethyl-, (E)-
    • AKOS000523077
    • BAS 00537893
    • HMS2766I03
    • NCGC00245484-01
    • SMR000280079
    • ETHENAMINE, 2-(2,6-DIMETHOXY-5-NITRO-4-PYRIMIDINYL)-N,N-DIMETHYL-
    • 2-(2,6-Dimethoxy-5-nitro-4-pyrimidinyl)-N,N-dimethylethenamine
    • Z56765915
    • 83256-18-2
    • SR-01000311811-1
    • SR-01000311811
    • BRN 4694966
    • MLS000717112
    • CHEMBL1484179
    • Inchi: 1S/C10H14N4O4/c1-13(2)6-5-7-8(14(15)16)9(17-3)12-10(11-7)18-4/h5-6H,1-4H3/b6-5+
    • InChI Key: PIBBRKLIDJCOTC-AATRIKPKSA-N
    • SMILES: O(C)C1=C(C(/C=C/N(C)C)=NC(=N1)OC)[N+](=O)[O-]

Computed Properties

  • Exact Mass: 254.10150494g/mol
  • Monoisotopic Mass: 254.10150494g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 7
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 4
  • Complexity: 305
  • 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: 1.2
  • Topological Polar Surface Area: 93.3?2
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