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Methyl 2-(2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-yl)acetate

HCID 67408974
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
COC(=O)Cc1ccc2c(n1)OCCO2
InChIKey
UYYJXFKNIPKAMA-UHFFFAOYSA-N
Molecular formula
C10H11NO4
Average molar mass
209.2 g/mol

Names & identifiers

Preferred name
Methyl 2-(2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-yl)acetate
IUPAC
methyl 2-(2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-yl)acetate

Names & synonyms

SCHEMBL2440894UYYJXFKNIPKAMA-UHFFFAOYSA-N615568-22-4DB-1815612,3-Dihydro-1,4-dioxino[2,3-b]pyridine-6-acetic acid methyl estermethyl 2-(2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-yl)acetate

Database identifiers

PubChem CID
67408974

Properties

Computed structural properties

XLogP
0.7
Topological polar surface area
57.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
15
Formal charge
0
Complexity
233

Related reactions

3 records
New reaction record
HRID 1913437 reaction equation
HRID 1913437As productuspto-grants-2013_12
HRID 1913438 reaction equation
HRID 1913438As reactantuspto-grants-2013_12
HRID 2339128 reaction equation
HRID 2339128As reactantTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes