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Home > Indoles and Oxindole > 477864-32-7
477864-32-7 | 2-(1-hydroxy-3-phenylpropan-2-yl)-2,3-dihydro-1H-isoindol-1-one
CAS No: 477864-32-7 Catalog No: AG00IO5C MDL No:MFCD02082957
Product Description
Catalog Number:
AG00IO5C
Chemical Name:
2-(1-hydroxy-3-phenylpropan-2-yl)-2,3-dihydro-1H-isoindol-1-one
CAS Number:
477864-32-7
Molecular Formula:
C17H17NO2
Molecular Weight:
267.3224
MDL Number:
MFCD02082957
IUPAC Name:
2-(1-hydroxy-3-phenylpropan-2-yl)-3H-isoindol-1-one
InChI:
InChI=1S/C17H17NO2/c19-12-15(10-13-6-2-1-3-7-13)18-11-14-8-4-5-9-16(14)17(18)20/h1-9,15,19H,10-12H2
InChI Key:
MVAXIJWHRHEUIG-UHFFFAOYSA-N
SMILES:
OCC(N1Cc2c(C1=O)cccc2)Cc1ccccc1
Properties
Complexity:
338
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.126g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
267.328g/mol
Monoisotopic Mass:
267.126g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
1
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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