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Ethyl 3-(2-methoxypyrimidin-5-yl)propionate

HCID 21936233
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CCOC(=O)CCc1cnc(OC)nc1
InChIKey
RMNCRAGILSCATK-UHFFFAOYSA-N
Molecular formula
C10H14N2O3
Average molar mass
210.23 g/mol

Names & identifiers

Preferred name
Ethyl 3-(2-methoxypyrimidin-5-yl)propionate
IUPAC
ethyl 3-(2-methoxypyrimidin-5-yl)propanoate

Names & synonyms

SCHEMBL4414143RMNCRAGILSCATK-UHFFFAOYSA-N224776-36-7DA-34220Ethyl 3-(2-methoxypyrimidin-5-yl)propionate

Database identifiers

PubChem CID
21936233

Properties

Computed structural properties

XLogP
1
Topological polar surface area
61.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
15
Formal charge
0
Complexity
191

Related reactions

4 records
New reaction record
HRID 411285 reaction equation
HRID 411285As productuspto-grants-2003_05
HRID 411286 reaction equation
HRID 411286As reactantuspto-grants-2003_05
HRID 818833 reaction equation
HRID 818833As productTest data from https://doi.org/10.1039/C8SC04228D
HRID 2228919 reaction equation
HRID 2228919As productuspto-grants-2002_07

Compound notes

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