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23378-97-4 | Benzenesulfonyl fluoride, 5-chloro-2-hydroxy-4-methyl-
CAS No: 23378-97-4 Catalog No: AG002N11 MDL No:
Product Description
Catalog Number:
AG002N11
Chemical Name:
Benzenesulfonyl fluoride, 5-chloro-2-hydroxy-4-methyl-
CAS Number:
23378-97-4
Molecular Formula:
C7H6ClFO3S
Molecular Weight:
224.6371
IUPAC Name:
5-chloro-2-hydroxy-4-methylbenzenesulfonyl fluoride
InChI:
InChI=1S/C7H6ClFO3S/c1-4-2-6(10)7(3-5(4)8)13(9,11)12/h2-3,10H,1H3
InChI Key:
JWFAESUCJZGWMS-UHFFFAOYSA-N
SMILES:
Cc1cc(O)c(cc1Cl)S(=O)(=O)F
Properties
Complexity:
274
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.971g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
224.63g/mol
Monoisotopic Mass:
223.971g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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