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16182-15-3 | Benzenesulfonic acid, 2,4,6-trimethyl-, hydrazide
CAS No: 16182-15-3 Catalog No: AG001VWS MDL No:MFCD00007585
Product Description
Catalog Number:
AG001VWS
Chemical Name:
Benzenesulfonic acid, 2,4,6-trimethyl-, hydrazide
CAS Number:
16182-15-3
Molecular Formula:
C9H14N2O2S
Molecular Weight:
214.2847
MDL Number:
MFCD00007585
IUPAC Name:
2,4,6-trimethylbenzenesulfonohydrazide
InChI:
InChI=1S/C9H14N2O2S/c1-6-4-7(2)9(8(3)5-6)14(12,13)11-10/h4-5,11H,10H2,1-3H3
InChI Key:
JQUBKTQDNVZHIY-UHFFFAOYSA-N
SMILES:
NNS(=O)(=O)c1c(C)cc(cc1C)C
EC Number:
240-319-4
NSC Number:
158041
Properties
Complexity:
272
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.078g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
214.283g/mol
Monoisotopic Mass:
214.078g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
80.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
Literature
| Title | Journal |
|---|---|
| Nucleophilic catalysis of acylhydrazone equilibration for protein-directed dynamic covalent chemistry. | Nature chemistry 20100601 |
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