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Home > Nitro Compounds > 88022-38-2
88022-38-2 | 2-Thiophenesulfonic acid, 2,4-dinitrophenyl ester
CAS No: 88022-38-2 Catalog No: AG004JLW MDL No:
Product Description
Catalog Number:
AG004JLW
Chemical Name:
2-Thiophenesulfonic acid, 2,4-dinitrophenyl ester
CAS Number:
88022-38-2
Molecular Formula:
C10H6N2O7S2
Molecular Weight:
330.2938
IUPAC Name:
(2,4-dinitrophenyl) thiophene-2-sulfonate
InChI:
InChI=1S/C10H6N2O7S2/c13-11(14)7-3-4-9(8(6-7)12(15)16)19-21(17,18)10-2-1-5-20-10/h1-6H
InChI Key:
YSKSBGKCLSIPRI-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(ccc1OS(=O)(=O)c1cccs1)[N+](=O)[O-]
Properties
Complexity:
507
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.962g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
330.285g/mol
Monoisotopic Mass:
329.962g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
172A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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