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41335-56-2 | 2-allyl-1,2-benzisothiazol-3(2H)-one 1,1-dioxide
CAS No: 41335-56-2 Catalog No: AG00CO5H MDL No:
Product Description
Catalog Number:
AG00CO5H
Chemical Name:
2-allyl-1,2-benzisothiazol-3(2H)-one 1,1-dioxide
CAS Number:
41335-56-2
IUPAC Name:
1,1-dioxo-2-prop-2-enyl-1,2-benzothiazol-3-one
InChI:
InChI=1S/C10H9NO3S/c1-2-7-11-10(12)8-5-3-4-6-9(8)15(11,13)14/h2-6H,1,7H2
InChI Key:
PCEMJUSXPJQKDP-UHFFFAOYSA-N
EC Number:
255-322-6
NSC Number:
39122
Properties
Complexity:
382
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.03g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.246g/mol
Monoisotopic Mass:
223.03g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
Literature
| Title | Journal |
|---|---|
| Contrasting responses of pyrido[2,1-a]isoindol-6-ones and their sultam counterparts to photochemical activation. | The Journal of organic chemistry 20090306 |
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