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Home > Indoles and Oxindole > 3335-98-6
3335-98-6 | 1-Phenylindolin-2-one
CAS No: 3335-98-6 Catalog No: AG003TBF MDL No:MFCD00234850
Product Description
Catalog Number:
AG003TBF
Chemical Name:
1-Phenylindolin-2-one
CAS Number:
3335-98-6
Molecular Formula:
C14H11NO
Molecular Weight:
209.2432
MDL Number:
MFCD00234850
IUPAC Name:
1-phenyl-3H-indol-2-one
InChI:
InChI=1S/C14H11NO/c16-14-10-11-6-4-5-9-13(11)15(14)12-7-2-1-3-8-12/h1-9H,10H2
InChI Key:
OWPNVXATCSXTBK-UHFFFAOYSA-N
SMILES:
O=C1Cc2c(N1c1ccccc1)cccc2
NSC Number:
234518
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:
0
Isotope Atom Count:
0
Molecular Weight:
209.248g/mol
Monoisotopic Mass:
209.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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 |
| TMC-95A analogues with endocyclic biphenyl ether group as proteasome inhibitors. | Chemistry & biodiversity 20040101 |
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