200,000+ products from a single source!
sales@angenechem.com
Home > Quinoline > 857211-12-2
857211-12-2 | 8-Quinolinesulfonicacid, hydrate (1:1)
CAS No: 857211-12-2 Catalog No: AG004SEN MDL No:MFCD16878228
Product Description
Catalog Number:
AG004SEN
Chemical Name:
8-Quinolinesulfonicacid, hydrate (1:1)
CAS Number:
857211-12-2
Molecular Formula:
C9H9NO4S
Molecular Weight:
227.2371
MDL Number:
MFCD16878228
IUPAC Name:
quinoline-8-sulfonic acid;hydrate
InChI:
InChI=1S/C9H7NO3S.H2O/c11-14(12,13)8-5-1-3-7-4-2-6-10-9(7)8;/h1-6H,(H,11,12,13);1H2
InChI Key:
KFSLGCMFBPUFKE-UHFFFAOYSA-N
SMILES:
OS(=O)(=O)c1cccc2c1nccc2.O
Properties
Complexity:
296
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.025g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
227.234g/mol
Monoisotopic Mass:
227.025g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
76.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.