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1-Methyl-2-oxindole

CAT: 0024-sc-224737Size: 5 gDry Ice: NoHazardous: No
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CAT#:0024-sc-224737Size:5 g
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CAS Number
61-70-1

Chemical Information

N-Methyloxindole
CAS Number61-70-1
PubChem CID6096
IUPAC Name1-methyl-3H-indol-2-one
Molecular FormulaC9H9NO
Molecular Weight147.17
XLogP1
Topological Polar Surface Area20.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count11
Formal Charge0
Complexity178
SMILES
CN1C(=O)CC2=CC=CC=C21
InChI
InChI=1S/C9H9NO/c1-10-8-5-3-2-4-7(8)6-9(10)11/h2-5H,6H2,1H3
InChIKey
RSQUAQMIGSMNNE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-Methyloxindole
CAS: 61-70-1
CID: 6096
Formula: C9H9NO
MW: 147.17
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight147.17
XLogP31
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass147.068413911
Monoisotopic Mass147.068413911
Topological Polar Surface Area20.3 Ų
Heavy Atom Count11
Formal Charge0
Complexity178
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