Home Sulfos methyl 5-(chlorosulfonyl)-4-fluoro-2-methylbenzoate

methyl 5-(chlorosulfonyl)-4-fluoro-2-methylbenzoate

CAS No.:
1566997-25-8
Catalog Number:
AG01AMOU
Molecular Formula:
C9H8ClFO4S
Molecular Weight:
266.6738
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Product Description
Catalog Number:
AG01AMOU
Chemical Name:
methyl 5-(chlorosulfonyl)-4-fluoro-2-methylbenzoate
CAS Number:
1566997-25-8
Molecular Formula:
C9H8ClFO4S
Molecular Weight:
266.6738
MDL Number:
MFCD26862938
IUPAC Name:
methyl 5-chlorosulfonyl-4-fluoro-2-methylbenzoate
InChI:
InChI=1S/C9H8ClFO4S/c1-5-3-7(11)8(16(10,13)14)4-6(5)9(12)15-2/h3-4H,1-2H3
InChI Key:
HWBBOCGDHXNZCC-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(c(cc1C)F)S(=O)(=O)Cl
Properties
Complexity:
364  
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:
3  
Topological Polar Surface Area:
68.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties