Benzoic acid, 3-(fluorosulfonyl)-


Chemical Name: Benzoic acid, 3-(fluorosulfonyl)-
CAS Number: 454-95-5
Product Number: AG00DW3J(AGN-PC-0JL86N)
Synonyms:
MDL No:
Molecular Formula: C7H5FO4S
Molecular Weight: 204.1756

Identification/Properties


Properties
MP:
147-153°C
BP:
358.8°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
204.171g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
203.989g/mol
Monoisotopic Mass:
203.989g/mol
Topological Polar Surface Area:
79.8A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
292
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:
Danger
UN#:
3265
Hazard Statements:
H314
Precautionary Statements:
P260-P280-P303+P361+P353-P301+P330+P331-P304+P340+P310-P305+P351+P338+P310
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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