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Home > Indoles and Oxindole > 74588-91-3
74588-91-3 | 1H-Indole-2,3-dione, 1-(2-oxo-2-phenylethyl)-
CAS No: 74588-91-3 Catalog No: AG005AN5 MDL No:
Product Description
Catalog Number:
AG005AN5
Chemical Name:
1H-Indole-2,3-dione, 1-(2-oxo-2-phenylethyl)-
CAS Number:
74588-91-3
Molecular Formula:
C16H11NO3
Molecular Weight:
265.2634
IUPAC Name:
1-phenacylindole-2,3-dione
InChI:
InChI=1S/C16H11NO3/c18-14(11-6-2-1-3-7-11)10-17-13-9-5-4-8-12(13)15(19)16(17)20/h1-9H,10H2
InChI Key:
HKGDVBFIYOUEMU-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1)CN1c2ccccc2C(=O)C1=O
Properties
Complexity:
425
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.074g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
265.268g/mol
Monoisotopic Mass:
265.074g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
54.4A^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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