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4-{[2-(2-Furyl)-1,3-oxazol-4-yl]methoxy}-3-methoxybenzaldehyde

HCID 86605705
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
COc1cc(C=O)ccc1OCc1coc(-c2ccco2)n1
InChIKey
IAPJFNODDDJZEQ-UHFFFAOYSA-N
Molecular formula
C16H13NO5
Average molar mass
299.28 g/mol

Names & identifiers

Preferred name
4-{[2-(2-Furyl)-1,3-oxazol-4-yl]methoxy}-3-methoxybenzaldehyde
IUPAC
4-[[2-(furan-2-yl)-1,3-oxazol-4-yl]methoxy]-3-methoxybenzaldehyde

Names & synonyms

SCHEMBL4845778IAPJFNODDDJZEQ-UHFFFAOYSA-N4-{[2-(2-furyl)-1,3-oxazol-4-yl]methoxy}-3-methoxybenzaldehyde

Database identifiers

PubChem CID
86605705

Properties

Computed structural properties

XLogP
2
Topological polar surface area
74.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
6
Heavy atoms
22
Formal charge
0
Complexity
366

Related reactions

4 records
New reaction record
HRID 208465 reaction equation
HRID 208465As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 211160 reaction equation
HRID 211160As productTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 2221506 reaction equation
HRID 2221506As productuspto-grants-2008_05
HRID 2221507 reaction equation
HRID 2221507As reactantuspto-grants-2008_05

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes