2,4-dihydroxy-7-methoxy-2H-1,4-Benzoxazin-3(4H)-one


Chemical Name: 2,4-dihydroxy-7-methoxy-2H-1,4-Benzoxazin-3(4H)-one
CAS Number: 15893-52-4
Product Number: AG001R0N(AGN-PC-0WAKDY)
Synonyms:
MDL No:
Molecular Formula: C9H9NO5
Molecular Weight: 211.1715

Identification/Properties


Computed Properties
Molecular Weight:
211.173g/mol
XLogP3:
0
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
211.048g/mol
Monoisotopic Mass:
211.048g/mol
Topological Polar Surface Area:
79.2A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
259
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
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:
H302-H315-H319-H335
Precautionary Statements:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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