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Home > Nitro Compounds > 88022-35-9
88022-35-9 | 2-Thiophenesulfonic acid, 4-nitrophenyl ester
CAS No: 88022-35-9 Catalog No: AG004GJP MDL No:
Product Description
Catalog Number:
AG004GJP
Chemical Name:
2-Thiophenesulfonic acid, 4-nitrophenyl ester
CAS Number:
88022-35-9
Molecular Formula:
C10H7NO5S2
Molecular Weight:
285.2963
IUPAC Name:
(4-nitrophenyl) thiophene-2-sulfonate
InChI:
InChI=1S/C10H7NO5S2/c12-11(13)8-3-5-9(6-4-8)16-18(14,15)10-2-1-7-17-10/h1-7H
InChI Key:
IJKPXFQNAJTZDW-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)OS(=O)(=O)c1cccs1
Properties
Complexity:
392
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.977g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.288g/mol
Monoisotopic Mass:
284.977g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
126A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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