D-Glucose, 2-deoxy-2-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]-


Chemical Name: D-Glucose, 2-deoxy-2-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]-
CAS Number: 186689-07-6
Product Number: AG00AQAJ(AGN-PC-0O5KHG)
Synonyms:
MDL No:
Molecular Formula: C12H14N4O8
Molecular Weight: 342.2616

Identification/Properties


Computed Properties
Molecular Weight:
342.264g/mol
XLogP3:
-1.4
Hydrogen Bond Donor Count:
5
Hydrogen Bond Acceptor Count:
11
Rotatable Bond Count:
7
Exact Mass:
342.081g/mol
Monoisotopic Mass:
342.081g/mol
Topological Polar Surface Area:
195A^2
Heavy Atom Count:
24
Formal Charge:
0
Complexity:
449
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
4
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P271-P280
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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