4-[(Methylamino)methyl]pyrocatechol Hydrobromide


Chemical Name: 4-[(Methylamino)methyl]pyrocatechol Hydrobromide
CAS Number: 1025423-95-3
Product Number: AG0007OY(AGN-PC-0WA9TV)
Synonyms:
MDL No: MFCD26045226
Molecular Formula: C8H12BrNO2
Molecular Weight: 234.0904

Identification/Properties


Properties
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
234.093g/mol
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
233.005g/mol
Monoisotopic Mass:
233.005g/mol
Topological Polar Surface Area:
52.5A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
119
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:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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