4-aminobenzene-1,2-diol;hydrobromide


Chemical Name: 4-aminobenzene-1,2-diol;hydrobromide
CAS Number: 158627-59-9
Product Number: AG001QDR(AGN-PC-068B2G)
Synonyms:
MDL No:
Molecular Formula: C6H8BrNO2
Molecular Weight: 206.0372

Identification/Properties


Computed Properties
Molecular Weight:
206.039g/mol
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
204.974g/mol
Monoisotopic Mass:
204.974g/mol
Topological Polar Surface Area:
66.5A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
97.1
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
2
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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