Home Sulfos ethyl 4-(chlorosulfonyl)-3-fluorobenzoate

ethyl 4-(chlorosulfonyl)-3-fluorobenzoate

CAS No.:
1063734-43-9
Catalog Number:
AG01C3X7
Molecular Formula:
C9H8ClFO4S
Molecular Weight:
266.6738
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Product Description
Catalog Number:
AG01C3X7
Chemical Name:
ethyl 4-(chlorosulfonyl)-3-fluorobenzoate
CAS Number:
1063734-43-9
Molecular Formula:
C9H8ClFO4S
Molecular Weight:
266.6738
MDL Number:
MFCD29762918
IUPAC Name:
ethyl 4-chlorosulfonyl-3-fluorobenzoate
InChI:
InChI=1S/C9H8ClFO4S/c1-2-15-9(12)6-3-4-8(7(11)5-6)16(10,13)14/h3-5H,2H2,1H3
InChI Key:
YWZRABLZZFXQJI-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccc(c(c1)F)S(=O)(=O)Cl
Properties
Complexity:
351  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.982g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.667g/mol
Monoisotopic Mass:
265.982g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
68.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties