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Home > Indoles and Oxindole > 19871-20-6
19871-20-6 | 1H-Isoindole-1,3(2H)-dione, 2-(phenylsulfonyl)-
CAS No: 19871-20-6 Catalog No: AG002BPM MDL No:
Product Description
Catalog Number:
AG002BPM
Chemical Name:
1H-Isoindole-1,3(2H)-dione, 2-(phenylsulfonyl)-
CAS Number:
19871-20-6
Molecular Formula:
C14H9NO4S
Molecular Weight:
287.2906
IUPAC Name:
2-(benzenesulfonyl)isoindole-1,3-dione
InChI:
InChI=1S/C14H9NO4S/c16-13-11-8-4-5-9-12(11)14(17)15(13)20(18,19)10-6-2-1-3-7-10/h1-9H
InChI Key:
WGXSKCHHCQOWDH-UHFFFAOYSA-N
SMILES:
O=C1c2ccccc2C(=O)N1S(=O)(=O)c1ccccc1
NSC Number:
23397
Properties
Complexity:
492
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.025g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
287.289g/mol
Monoisotopic Mass:
287.025g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
79.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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