Home Sulfos 4-[4-(chlorosulfonyl)-2-fluorophenoxy]butanoic acid

4-[4-(chlorosulfonyl)-2-fluorophenoxy]butanoic acid

CAS No.:
1016838-81-5
Catalog Number:
AG01A97N
Molecular Formula:
C10H10ClFO5S
Molecular Weight:
296.6998
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Product Description
Catalog Number:
AG01A97N
Chemical Name:
4-[4-(chlorosulfonyl)-2-fluorophenoxy]butanoic acid
CAS Number:
1016838-81-5
Molecular Formula:
C10H10ClFO5S
Molecular Weight:
296.6998
IUPAC Name:
4-(4-chlorosulfonyl-2-fluorophenoxy)butanoic acid
InChI:
InChI=1S/C10H10ClFO5S/c11-18(15,16)7-3-4-9(8(12)6-7)17-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)
InChI Key:
GAJJWMGAJLYABH-UHFFFAOYSA-N
SMILES:
OC(=O)CCCOc1ccc(cc1F)S(=O)(=O)Cl
Properties
Complexity:
380  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.992g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
296.693g/mol
Monoisotopic Mass:
295.992g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
89A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties