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Home > Indoles and Oxindole > 89313-76-8
89313-76-8 | 1H-Isoindole-1-thione, 2,3-dihydro-2-phenyl-
CAS No: 89313-76-8 Catalog No: AG003YJ5 MDL No:
Product Description
Catalog Number:
AG003YJ5
Chemical Name:
1H-Isoindole-1-thione, 2,3-dihydro-2-phenyl-
CAS Number:
89313-76-8
Molecular Formula:
C14H11NS
Molecular Weight:
225.3088
IUPAC Name:
2-phenyl-3H-isoindole-1-thione
InChI:
InChI=1S/C14H11NS/c16-14-13-9-5-4-6-11(13)10-15(14)12-7-2-1-3-8-12/h1-9H,10H2
InChI Key:
LSMGPJAXAJUTHT-UHFFFAOYSA-N
SMILES:
S=C1N(Cc2c1cccc2)c1ccccc1
Properties
Complexity:
270
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.061g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.309g/mol
Monoisotopic Mass:
225.061g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
35.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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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