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14661-69-9 | Benzenesulfonic acid, 4-methyl-, 2-(2-chloro-2-oxoethylidene)hydrazide
CAS No: 14661-69-9 Catalog No: AG001E7B MDL No:
Product Description
Catalog Number:
AG001E7B
Chemical Name:
Benzenesulfonic acid, 4-methyl-, 2-(2-chloro-2-oxoethylidene)hydrazide
CAS Number:
14661-69-9
Molecular Formula:
C9H9ClN2O3S
Molecular Weight:
260.6974
IUPAC Name:
2-[(4-methylphenyl)sulfonylhydrazinylidene]acetyl chloride
InChI:
InChI=1S/C9H9ClN2O3S/c1-7-2-4-8(5-3-7)16(14,15)12-11-6-9(10)13/h2-6,12H,1H3
InChI Key:
HQXCAVDYGRHYMF-UHFFFAOYSA-N
SMILES:
ClC(=O)C=NNS(=O)(=O)c1ccc(cc1)C
Properties
Complexity:
367
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.002g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
260.692g/mol
Monoisotopic Mass:
260.002g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
84A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.7
Literature
| Title | Journal |
|---|---|
| Total synthesis of spirotenuipesines A and B. | The Journal of organic chemistry 20081219 |
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