Home Sulfos 4-cyano-3-fluorobenzene-1-sulfonyl chloride

4-cyano-3-fluorobenzene-1-sulfonyl chloride

CAS No.:
881674-66-4
Catalog Number:
AG01ALDB
Molecular Formula:
C7H3ClFNO2S
Molecular Weight:
219.6206
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Product Description
Catalog Number:
AG01ALDB
Chemical Name:
4-cyano-3-fluorobenzene-1-sulfonyl chloride
CAS Number:
881674-66-4
Molecular Formula:
C7H3ClFNO2S
Molecular Weight:
219.6206
MDL Number:
MFCD11875870
IUPAC Name:
4-cyano-3-fluorobenzenesulfonyl chloride
InChI:
InChI=1S/C7H3ClFNO2S/c8-13(11,12)6-2-1-5(4-10)7(9)3-6/h1-3H
InChI Key:
BQOLEECFBQEGJC-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1F)S(=O)(=O)Cl
Properties
Complexity:
328  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.956g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.614g/mol
Monoisotopic Mass:
218.956g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties