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Home > Indoles and Oxindole > 76325-79-6
76325-79-6 | 3-Hydroxy-3-(2-oxo-cyclohexyl)-1,3-dihydro-indol-2-one
CAS No: 76325-79-6 Catalog No: AG01EXBN MDL No:
Product Description
Catalog Number:
AG01EXBN
Chemical Name:
3-Hydroxy-3-(2-oxo-cyclohexyl)-1,3-dihydro-indol-2-one
CAS Number:
76325-79-6
Molecular Formula:
C14H15NO3
Molecular Weight:
245.2738
IUPAC Name:
3-hydroxy-3-(2-oxocyclohexyl)-1H-indol-2-one
InChI:
InChI=1S/C14H15NO3/c16-12-8-4-2-6-10(12)14(18)9-5-1-3-7-11(9)15-13(14)17/h1,3,5,7,10,18H,2,4,6,8H2,(H,15,17)
InChI Key:
VWHKAOILSLADJS-UHFFFAOYSA-N
SMILES:
O=C1CCCCC1C1(O)C(=O)Nc2c1cccc2
NSC Number:
234305
Properties
Complexity:
381
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.105g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
245.278g/mol
Monoisotopic Mass:
245.105g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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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