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Home > Nitro Compounds > 22117-82-4
22117-82-4 | 3-methoxy-4-nitrobenzene-1-sulfonamide
CAS No: 22117-82-4 Catalog No: AG019ZRB MDL No:MFCD18398361
Product Description
Catalog Number:
AG019ZRB
Chemical Name:
3-methoxy-4-nitrobenzene-1-sulfonamide
CAS Number:
22117-82-4
Molecular Formula:
C7H8N2O5S
Molecular Weight:
232.2138
MDL Number:
MFCD18398361
IUPAC Name:
3-methoxy-4-nitrobenzenesulfonamide
InChI:
InChI=1S/C7H8N2O5S/c1-14-7-4-5(15(8,12)13)2-3-6(7)9(10)11/h2-4H,1H3,(H2,8,12,13)
InChI Key:
ITLDNUYYVVFHER-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1[N+](=O)[O-])S(=O)(=O)N
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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