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203340-03-8

203340-03-8 | sodium isoquinoline-5-sulfinate

CAS No: 203340-03-8 Catalog No: AG01C894 MDL No:MFCD31441008

Product Description

Catalog Number:
AG01C894
Chemical Name:
sodium isoquinoline-5-sulfinate
CAS Number:
203340-03-8
Molecular Formula:
C9H6NNaO2S
Molecular Weight:
215.2042
MDL Number:
MFCD31441008
IUPAC Name:
sodium;isoquinoline-5-sulfinate
InChI:
InChI=1S/C9H7NO2S.Na/c11-13(12)9-3-1-2-7-6-10-5-4-8(7)9;/h1-6H,(H,11,12);/q;+1/p-1
InChI Key:
JWTSJGFGWRQMHF-UHFFFAOYSA-M
SMILES:
[O-]S(=O)c1cccc2c1ccnc2.[Na+]

Properties

Complexity:
215  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.002g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
215.202g/mol
Monoisotopic Mass:
215.002g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
72.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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