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Home > Nitro Compounds > 22939-93-1
22939-93-1 | Benzenesulfonamide, 4-methoxy-3-nitro-
CAS No: 22939-93-1 Catalog No: AG002LL2 MDL No:MFCD08163434
Product Description
Catalog Number:
AG002LL2
Chemical Name:
Benzenesulfonamide, 4-methoxy-3-nitro-
CAS Number:
22939-93-1
Molecular Formula:
C7H8N2O5S
Molecular Weight:
232.2138
MDL Number:
MFCD08163434
IUPAC Name:
4-methoxy-3-nitrobenzenesulfonamide
InChI:
InChI=1S/C7H8N2O5S/c1-14-7-3-2-5(15(8,12)13)4-6(7)9(10)11/h2-4H,1H3,(H2,8,12,13)
InChI Key:
JESBYSXPKUMFRV-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1[N+](=O)[O-])S(=O)(=O)N
EC Number:
245-339-7
NSC Number:
231682
Properties
Complexity:
330
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.015g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
232.21g/mol
Monoisotopic Mass:
232.015g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
124A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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