Cas no 29838-70-8 (Glucopyranose,2-deoxy-2-(3-ethyl-3-nitrosoureido)-, D- (8CI))

Glucopyranose,2-deoxy-2-(3-ethyl-3-nitrosoureido)-, D- (8CI) structure
29838-70-8 structure
Product Name:Glucopyranose,2-deoxy-2-(3-ethyl-3-nitrosoureido)-, D- (8CI)
CAS No:29838-70-8
MF:C9H17N3O7
MW:279.247182607651
CID:287112
PubChem ID:300414
Update Time:2025-04-19

Glucopyranose,2-deoxy-2-(3-ethyl-3-nitrosoureido)-, D- (8CI) Chemical and Physical Properties

Names and Identifiers

    • Glucopyranose,2-deoxy-2-(3-ethyl-3-nitrosoureido)-, D- (8CI)
    • 1-ethyl-1-nitroso-3-[2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]urea
    • 2-deoxy-2-{[ethyl(nitroso)carbamoyl]amino}hexopyranose
    • AC1L6W9Z
    • NSC174793
    • 29838-70-8
    • DTXSID90306260
    • NSC-174793
    • Inchi: 1S/C9H17N3O7/c1-2-12(11-18)9(17)10-5-7(15)6(14)4(3-13)19-8(5)16/h4-8,13-16H,2-3H2,1H3,(H,10,17)
    • InChI Key: IXFMPDXUKARPQP-UHFFFAOYSA-N
    • SMILES: O1C(C(C(C(C1CO)O)O)NC(N(CC)N=O)=O)O

Computed Properties

  • Exact Mass: 279.10671
  • Monoisotopic Mass: 279.107
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 5
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 3
  • Complexity: 329
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 5
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: _1.1
  • Topological Polar Surface Area: 152?2

Experimental Properties

  • Density: 1.76
  • Refractive Index: 1.65
  • PSA: 151.92
  • LogP: -2.10990
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