Home Sulfos 4-ethynylbenzene-1-sulfonyl fluoride

4-ethynylbenzene-1-sulfonyl fluoride

CAS No.:
2138217-02-2
Catalog Number:
AG01EIUR
Molecular Formula:
C8H5FO2S
Molecular Weight:
184.1875
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Product Description
Catalog Number:
AG01EIUR
Chemical Name:
4-ethynylbenzene-1-sulfonyl fluoride
CAS Number:
2138217-02-2
Molecular Formula:
C8H5FO2S
Molecular Weight:
184.1875
MDL Number:
MFCD31421783
IUPAC Name:
4-ethynylbenzenesulfonyl fluoride
InChI:
InChI=1S/C8H5FO2S/c1-2-7-3-5-8(6-4-7)12(9,10)11/h1,3-6H
InChI Key:
WQGGBIBRCKVFND-UHFFFAOYSA-N
SMILES:
C#Cc1ccc(cc1)S(=O)(=O)F
Properties
Complexity:
285  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.999g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.184g/mol
Monoisotopic Mass:
183.999g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties