Boronicacid, B-(3-mercaptophenyl)-


Chemical Name: Boronicacid, B-(3-mercaptophenyl)-
CAS Number: 352526-01-3
Product Number: AG00C0CD(AGN-PC-0KKVSC)
Synonyms:
MDL No:
Molecular Formula: C6H7BO2S
Molecular Weight: 153.9946

Identification/Properties


Properties
MP:
196-201 °C(lit.)
BP:
345.3±44.0 °C at 760 mmHg
Storage:
2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
153.99g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
154.026g/mol
Monoisotopic Mass:
154.026g/mol
Topological Polar Surface Area:
41.5A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
110
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:
P261-P280-P305+P351+P338-P304+P340
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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