5-(4-Chlorophenyl)-2-methyl-3-furaldehyde

HCID 21986471
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Basic information

Standard SMILES
Cc1oc(-c2ccc(Cl)cc2)cc1C=O
InChIKey
OMXZAQXOTQRTDK-UHFFFAOYSA-N
Molecular formula
C12H9ClO2
Average molar mass
220.65 g/mol

Names & identifiers

Preferred name
5-(4-Chlorophenyl)-2-methyl-3-furaldehyde
IUPAC
5-(4-chlorophenyl)-2-methylfuran-3-carbaldehyde

Names & synonyms

SCHEMBL3100220SCHEMBL4991969OMXZAQXOTQRTDK-UHFFFAOYSA-N5-(4-chlorophenyl)-2-methyl-3-furaldehyde

Database identifiers

PubChem CID
21986471

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
30.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
15

Related reactions

3 records
New reaction record

Linked notes

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5-(4-Chlorophenyl)-2-methyl-3-furaldehyde (HCID 21986471)｜Huagongshe