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Home > Nitro Compounds > 89412-53-3
89412-53-3 | Benzenesulfonamide, 5-nitro-2-(2-propenyloxy)-
CAS No: 89412-53-3 Catalog No: AG0043ZZ MDL No:
Product Description
Catalog Number:
AG0043ZZ
Chemical Name:
Benzenesulfonamide, 5-nitro-2-(2-propenyloxy)-
CAS Number:
89412-53-3
Molecular Formula:
C9H10N2O5S
Molecular Weight:
258.2511
IUPAC Name:
5-nitro-2-prop-2-enoxybenzenesulfonamide
InChI:
InChI=1S/C9H10N2O5S/c1-2-5-16-8-4-3-7(11(12)13)6-9(8)17(10,14)15/h2-4,6H,1,5H2,(H2,10,14,15)
InChI Key:
VGMIZGZACFWYHZ-UHFFFAOYSA-N
SMILES:
C=CCOc1ccc(cc1S(=O)(=O)N)[N+](=O)[O-]
Properties
Complexity:
383
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.031g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
258.248g/mol
Monoisotopic Mass:
258.031g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
124A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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