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1000577-69-4 | 3-Bromo-5-(4-fluorophenylsulfonyl)-1,2,4-thiadiazole
CAS No: 1000577-69-4 Catalog No: AG01F8DQ MDL No:
Product Description
Catalog Number:
AG01F8DQ
Chemical Name:
3-Bromo-5-(4-fluorophenylsulfonyl)-1,2,4-thiadiazole
CAS Number:
1000577-69-4
Molecular Formula:
C8H4BrFN2O2S2
Molecular Weight:
323.1620
IUPAC Name:
3-bromo-5-(4-fluorophenyl)sulfonyl-1,2,4-thiadiazole
InChI:
InChI=1S/C8H4BrFN2O2S2/c9-7-11-8(15-12-7)16(13,14)6-3-1-5(10)2-4-6/h1-4H
InChI Key:
GRXBONVOSQJWOJ-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)S(=O)(=O)c1snc(n1)Br
Properties
Complexity:
340
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
321.888g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
323.154g/mol
Monoisotopic Mass:
321.888g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
96.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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