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2-Indolone

CAT: 0926-FI24580-02Size: 1 KgDry Ice: NoHazardous: No
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CAT#:0926-FI24580-02Size:1 Kg
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CAS Number
59-48-3
Synonyms
1,3-Dihydro-2H-indol-2-one
MDL Number
MFCD00005711
Smiles
C1C2=CC=CC=C2NC1=O
Molecular Formula
C8H7NO
Molecular Weight
133.15 g/mol
Controlled
No

Chemical Information

Oxindole

Indolin-2-one is an indolinone carrying an oxo group at position 2. It is an indolinone and a gamma-lactam.

CAS Number59-48-3
PubChem CID321710
IUPAC Name1,3-dihydroindol-2-one
Molecular FormulaC8H7NO
Molecular Weight133.15
XLogP1.2
Topological Polar Surface Area29.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count10
Formal Charge0
Complexity155
SMILES
C1C2=CC=CC=C2NC1=O
InChI
InChI=1S/C8H7NO/c10-8-5-6-3-1-2-4-7(6)9-8/h1-4H,5H2,(H,9,10)
InChIKey
JYGFTBXVXVMTGB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Oxindole
CAS: 59-48-3
CID: 321710
Formula: C8H7NO
MW: 133.15
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight133.15
XLogP31.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass133.052763847
Monoisotopic Mass133.052763847
Topological Polar Surface Area29.1 Ų
Heavy Atom Count10
Formal Charge0
Complexity155
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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