CAS
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3-Acetyl-1-ethyl-4-hydroxy-2(1H)-quinolinone
Catalog Number
ACMA00001085
Category
Amines
Molecular Weight
231.25
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Specification
Hazard Statements
H315-H319-H335
RIDADR
NONH for all modes of transport
Symbol
GHS07
What is the molecular formula of 3-Acetyl-1-ethyl-4-hydroxy-2(1H)-quinolinone?
The molecular formula is C13H13NO3.
What is the molecular weight of 3-Acetyl-1-ethyl-4-hydroxy-2(1H)-quinolinone?
The molecular weight is 231.25 g/mol.
What is the IUPAC name of 3-Acetyl-1-ethyl-4-hydroxy-2(1H)-quinolinone?
The IUPAC name is 3-acetyl-1-ethyl-4-hydroxyquinolin-2-one.
What is the InChI of 3-Acetyl-1-ethyl-4-hydroxy-2(1H)-quinolinone?
The InChI is InChI=1S/C13H13NO3/c1-3-14-10-7-5-4-6-9(10)12(16)11(8(2)15)13(14)17/h4-7,16H,3H2,1-2H3.
What is the InChIKey of 3-Acetyl-1-ethyl-4-hydroxy-2(1H)-quinolinone?
The InChIKey is MAXQRHZHOYEQQM-UHFFFAOYSA-N.
What is the canonical SMILES of 3-Acetyl-1-ethyl-4-hydroxy-2(1H)-quinolinone?
The canonical SMILES is CCN1C2=CC=CC=C2C(=C(C1=O)C(=O)C)O.
What is the XLogP3-AA value of 3-Acetyl-1-ethyl-4-hydroxy-2(1H)-quinolinone?
The XLogP3-AA value is 1.7.
How many hydrogen bond donor counts does 3-Acetyl-1-ethyl-4-hydroxy-2(1H)-quinolinone have?
It has 1 hydrogen bond donor count.
How many hydrogen bond acceptor counts does 3-Acetyl-1-ethyl-4-hydroxy-2(1H)-quinolinone have?
It has 3 hydrogen bond acceptor counts.
How many rotatable bond counts does 3-Acetyl-1-ethyl-4-hydroxy-2(1H)-quinolinone have?
It has 2 rotatable bond counts.
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