5-Amino-1,3,3-trimethyl-indolin-2-one

CAS

953048-71-0

Catalog Number

ACM953048710

Category

Other Products

Molecular Weight

190.245

Molecular Formula

C₁₁H₁₄N₂O

MSDS COA Spec Sheet

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Specification

Synonyms

5-AMINO-1,3,3-TRIMETHYL-INDOLIN-2-ONE, 953048-71-0, 5-Amino-1,3,3-trimethyl-2-oxoindoline, CTK8E2527, MolPort-019-867-067, 5-amino-1,3,3-trimethyl-2-indolone, 5-amino-1,3,3-trimethylindol-2-one, AKOS015950277, PB31822, RP07396, 5-azanyl-1,3,3-trimethyl-indol-2-one, AB1011771, AM20041462, FT-0684688, Y4829, 5-AMINO-1,3,3-TRIMETHYL-2-OXINDOLE, C-8484, A845271, 5-amino-1,3,3-trimethyl-2,3-dihydro-1H-indol-2-one, 5-AMINO-1,3,3-TRIMETHYL-1,3-DIHYDRO-INDOL-2-ONE

IUPAC Name

5-amino-1,3,3-trimethylindol-2-one

Canonical SMILES

CC1(C2=C(C=CC(=C2)N)N(C1=O)C)C

InChI Key

KJJOSNCOZFAVSP-UHFFFAOYSA-N

Exact Mass

190.11100

H-Bond Acceptor

H-Bond Donor

What is the molecular formula of the compound with PubChem CID 52911276?

The molecular formula is C11H14N2O.

What are the synonyms for the compound with PubChem CID 52911276?

The synonyms are 953048-71-0, 5-AMINO-1,3,3-TRIMETHYL-INDOLIN-2-ONE, 5-amino-1,3,3-trimethyl-2,3-dihydro-1H-indol-2-one, and 5-Amino-1,3,3-trimethylindolin-2-one.

How is the IUPAC name of the compound computed?

The IUPAC name of the compound is computed as 5-amino-1,3,3-trimethylindol-2-one.

What is the InChI of the compound?

The InChI of the compound is "InChI=1S/C11H14N2O/c1-11(2)8-6-7(12)4-5-9(8)13(3)10(11)14/h4-6H,12H2,1-3H3".

What is the InChIKey of the compound?

The InChIKey of the compound is "KJJOSNCOZFAVSP-UHFFFAOYSA-N".

What is the canonical SMILES of the compound?

The canonical SMILES of the compound is "CC1(C2=C(C=CC(=C2)N)N(C1=O)C)C".

What is the molecular weight of the compound?

The molecular weight of the compound is 190.24 g/mol.

What is the XLogP3-AA value of the compound?

The XLogP3-AA value of the compound is 1.2.