Benzoic acid, 2-bromo-5-(chlorosulfonyl)-


Chemical Name: Benzoic acid, 2-bromo-5-(chlorosulfonyl)-
CAS Number: 3285-31-2
Product Number: AG00C8E1(AGN-PC-0KU81P)
Synonyms:
MDL No:
Molecular Formula: C7H4BrClO4S
Molecular Weight: 299.5263

Identification/Properties


Computed Properties
Molecular Weight:
299.519g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
297.87g/mol
Monoisotopic Mass:
297.87g/mol
Topological Polar Surface Area:
79.8A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
323
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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