Home Sulfos 4-[(acetylamino)methyl]benzenesulfonyl fluoride

4-[(acetylamino)methyl]benzenesulfonyl fluoride

CAS No.:
33719-21-0
Catalog Number:
AG007IX9
Molecular Formula:
C9H10FNO3S
Molecular Weight:
231.2440
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Product Description
Catalog Number:
AG007IX9
Chemical Name:
4-[(acetylamino)methyl]benzenesulfonyl fluoride
CAS Number:
33719-21-0
Molecular Formula:
C9H10FNO3S
Molecular Weight:
231.2440
MDL Number:
MFCD01658027
IUPAC Name:
4-(acetamidomethyl)benzenesulfonyl fluoride
InChI:
InChI=1S/C9H10FNO3S/c1-7(12)11-6-8-2-4-9(5-3-8)15(10,13)14/h2-5H,6H2,1H3,(H,11,12)
InChI Key:
MHDPNRPBTSKUAW-UHFFFAOYSA-N
SMILES:
CC(=O)NCc1ccc(cc1)S(=O)(=O)F
Properties
Complexity:
315  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.037g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
231.241g/mol
Monoisotopic Mass:
231.037g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
71.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties