CAS
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1-Ethyl-3-methyl-2-oxo-1,2-dihydroquinoxaline-6-carboxylic acid
Catalog Number
ACMA00001040
Category
Amines
Molecular Weight
232.24
Molecular Formula
C12H11NO3
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Specification
Hazard Statements
H350
RIDADR
NONH for all modes of transport
Symbol
GHS08
What is the molecular formula of the compound with PubChem CID 4962182?
The molecular formula is C12H12N2O3.
When was the compound created in the PubChem database?
The compound was created on September 17, 2005.
What is the computed IUPAC name of the compound?
The computed IUPAC name is 1-ethyl-3-methyl-2-oxoquinoxaline-6-carboxylic acid.
What is the Canonical SMILES representation of the compound?
The Canonical SMILES representation is CCN1C2=C(C=C(C=C2)C(=O)O)N=C(C1=O)C.
What is the molecular weight of the compound?
The molecular weight is 232.23 g/mol.
How many Hydrogen Bond Acceptor Count does the compound have?
The compound has 4 Hydrogen Bond Acceptor Count.
What is the Topological Polar Surface Area of the compound?
The Topological Polar Surface Area is 70Ų.
How many Heavy Atoms does the compound contain?
The compound contains 17 Heavy Atoms.
Is the Compound Is Canonicalized in PubChem?
Yes, the Compound Is Canonicalized.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value is 0.8.
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