Home Sulfos 2H-Naphth[1,8-cd]isothiazole-3,5-disulfonicacid, 1,1-dioxide

2H-Naphth[1,8-cd]isothiazole-3,5-disulfonicacid, 1,1-dioxide

CAS No.:
82-65-5
Catalog Number:
AG008JYI
Molecular Formula:
C10H7NO8S3
Molecular Weight:
365.3595
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
tech.
1 week
United States
$337
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Product Description
Catalog Number:
AG008JYI
Chemical Name:
2H-Naphth[1,8-cd]isothiazole-3,5-disulfonicacid, 1,1-dioxide
CAS Number:
82-65-5
Molecular Formula:
C10H7NO8S3
Molecular Weight:
365.3595
MDL Number:
MFCD00961070
IUPAC Name:
2,2-dioxo-2λ6-thia-3-azatricyclo[6.3.1.04,12]dodeca-1(11),4,6,8(12),9-pentaene-5,7-disulfonic acid
InChI:
InChI=1S/C10H7NO8S3/c12-20(13)6-3-1-2-5-7(21(14,15)16)4-8(22(17,18)19)10(11-20)9(5)6/h1-4,11H,(H,14,15,16)(H,17,18,19)
InChI Key:
SOEOLOYSOQPCII-UHFFFAOYSA-N
SMILES:
OS(=O)(=O)c1cc(c2c3c1NS(=O)(=O)c3ccc2)S(=O)(=O)O
EC Number:
201-432-4
Properties
Complexity:
770  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
364.933g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
365.345g/mol
Monoisotopic Mass:
364.933g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
180A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7  
Properties