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65613-20-9 | 7,8-QUINOLINEDISULFONIC ACID
CAS No: 65613-20-9 Catalog No: AG006QMJ MDL No:
Product Description
Catalog Number:
AG006QMJ
Chemical Name:
7,8-QUINOLINEDISULFONIC ACID
CAS Number:
65613-20-9
Molecular Formula:
C9H7NO6S2
Molecular Weight:
289.2850
IUPAC Name:
quinoline-7,8-disulfonic acid
InChI:
InChI=1S/C9H7NO6S2/c11-17(12,13)7-4-3-6-2-1-5-10-8(6)9(7)18(14,15)16/h1-5H,(H,11,12,13)(H,14,15,16)
InChI Key:
ZCBMLNBZLPKQLP-UHFFFAOYSA-N
SMILES:
OS(=O)(=O)c1c2ncccc2ccc1S(=O)(=O)O
Properties
Complexity:
502
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.971g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
289.276g/mol
Monoisotopic Mass:
288.971g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
138A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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