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4-(Benzofuran-2-yl)benzaldehyde

HCID 11379052
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
O=Cc1ccc(-c2cc3ccccc3o2)cc1
InChIKey
RRERCNLWKDJQGK-UHFFFAOYSA-N
Molecular formula
C15H10O2
Average molar mass
222.24 g/mol

Names & identifiers

Preferred name
4-(Benzofuran-2-yl)benzaldehyde
IUPAC
4-(1-benzofuran-2-yl)benzaldehyde

Names & synonyms

4-(benzofuran-2-yl)benzaldehyde4-(1-benzofuran-2-yl)benzaldehydeSCHEMBL10358139

Database identifiers

PubChem CID
11379052
Nikkaji
J3.735.910F

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
30.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
17
Formal charge
0
Complexity
268

Related reactions

1 records
New reaction record
HRID 103904 reaction equation
HRID 103904As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes