Benzo[b]thiophene, 6-nitro-, 1,1-dioxide


Chemical Name: Benzo[b]thiophene, 6-nitro-, 1,1-dioxide
CAS Number: 19983-44-9
Product Number: AG002CE6(AGN-PC-0KKZV2)
Synonyms:
MDL No:
Molecular Formula: C8H5NO4S
Molecular Weight: 211.1946

Identification/Properties


Properties
BP:
461.1°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Solubility:
DMSO: >20mg/mL
Computed Properties
Molecular Weight:
211.191g/mol
XLogP3:
0.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
0
Exact Mass:
210.994g/mol
Monoisotopic Mass:
210.994g/mol
Topological Polar Surface Area:
88.3A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
375
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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