[3-(dimethylsulfamoylamino)phenyl]boronic acid


Chemical Name: [3-(dimethylsulfamoylamino)phenyl]boronic acid
CAS Number: 277295-50-8
Product Number: AG002ULS(AGN-PC-0713KB)
Synonyms:
MDL No: MFCD08235107
Molecular Formula: C8H13BN2O4S
Molecular Weight: 244.0758

Identification/Properties


Properties
MP:
129-132
BP:
438.5°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
244.072g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
4
Exact Mass:
244.069g/mol
Monoisotopic Mass:
244.069g/mol
Topological Polar Surface Area:
98.2A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
315
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:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302
Precautionary Statements:
P264-P270-P301+P312+P330-P501
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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