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Home > Indoles and Oxindole > 19065-85-1
19065-85-1 | 1H-Isoindole-1,3(2H)-dione, 4-nitro-2-phenyl-
CAS No: 19065-85-1 Catalog No: AG002EPY MDL No:
Product Description
Catalog Number:
AG002EPY
Chemical Name:
1H-Isoindole-1,3(2H)-dione, 4-nitro-2-phenyl-
CAS Number:
19065-85-1
Molecular Formula:
C14H8N2O4
Molecular Weight:
268.2243
IUPAC Name:
4-nitro-2-phenylisoindole-1,3-dione
InChI:
InChI=1S/C14H8N2O4/c17-13-10-7-4-8-11(16(19)20)12(10)14(18)15(13)9-5-2-1-3-6-9/h1-8H
InChI Key:
OMOHDUGKQSTKSR-UHFFFAOYSA-N
SMILES:
O=C1c2cccc(c2C(=O)N1c1ccccc1)[N+](=O)[O-]
NSC Number:
117486
Properties
Complexity:
439
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.048g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
268.228g/mol
Monoisotopic Mass:
268.048g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
83.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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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