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Home > Indoles and Oxindole > 1956322-70-5
1956322-70-5 | 3-(Tetrahydro-2H-Pyran-4-Yl)Indolin-2-One
CAS No: 1956322-70-5 Catalog No: AG01DTWL MDL No:MFCD28991819
Product Description
Catalog Number:
AG01DTWL
Chemical Name:
3-(Tetrahydro-2H-Pyran-4-Yl)Indolin-2-One
CAS Number:
1956322-70-5
Molecular Formula:
C13H15NO2
Molecular Weight:
217.2637
MDL Number:
MFCD28991819
IUPAC Name:
3-(oxan-4-yl)-1,3-dihydroindol-2-one
InChI:
InChI=1S/C13H15NO2/c15-13-12(9-5-7-16-8-6-9)10-3-1-2-4-11(10)14-13/h1-4,9,12H,5-8H2,(H,14,15)
InChI Key:
KVNZNWUQHBSHHS-UHFFFAOYSA-N
SMILES:
O=C1Nc2c(C1C1CCOCC1)cccc2
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.11g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
217.268g/mol
Monoisotopic Mass:
217.11g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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