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803634-97-1

803634-97-1 | 8-Quinolinesulfonicacid, 5-iodo-

CAS No: 803634-97-1 Catalog No: AG005M7T MDL No:

Product Description

Catalog Number:
AG005M7T
Chemical Name:
8-Quinolinesulfonicacid, 5-iodo-
CAS Number:
803634-97-1
Molecular Formula:
C9H6INO3S
Molecular Weight:
335.1183
IUPAC Name:
5-iodoquinoline-8-sulfonic acid
InChI:
InChI=1S/C9H6INO3S/c10-7-3-4-8(15(12,13)14)9-6(7)2-1-5-11-9/h1-5H,(H,12,13,14)
InChI Key:
CPRCQMSVBMQOEK-UHFFFAOYSA-N
SMILES:
Ic1ccc(c2c1cccn2)S(=O)(=O)O

Properties

Complexity:
327  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
334.911g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
335.115g/mol
Monoisotopic Mass:
334.911g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  

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