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Home > Indoles and Oxindole > 3456-79-9
3456-79-9 | 3-Phenyl-oxindole
CAS No: 3456-79-9 Catalog No: AG007EVY MDL No:MFCD00158550
Product Description
Catalog Number:
AG007EVY
Chemical Name:
3-Phenyl-oxindole
CAS Number:
3456-79-9
Molecular Formula:
C14H11NO
Molecular Weight:
209.2432
MDL Number:
MFCD00158550
IUPAC Name:
3-phenyl-1,3-dihydroindol-2-one
InChI:
InChI=1S/C14H11NO/c16-14-13(10-6-2-1-3-7-10)11-8-4-5-9-12(11)15-14/h1-9,13H,(H,15,16)
InChI Key:
PAMMIXSSIGTOAK-UHFFFAOYSA-N
SMILES:
O=C1Nc2c(C1c1ccccc1)cccc2
NSC Number:
249786
Properties
Complexity:
270
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.084g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
209.248g/mol
Monoisotopic Mass:
209.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Literature
| Title | Journal |
|---|---|
| Evaluation of 'click' binaphthyl chiral stationary phases by liquid chromatography. | Chirality 20120501 |
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