4-(2,3-Dihydroxypropoxy)benzaldehyde

HCID 16655848
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Basic information

Standard SMILES
O=Cc1ccc(OCC(O)CO)cc1
InChIKey
QEZPUQMNWKYVDS-UHFFFAOYSA-N
Molecular formula
C10H12O4
Average molar mass
196.2 g/mol

Names & identifiers

Preferred name
4-(2,3-Dihydroxypropoxy)benzaldehyde
IUPAC
4-(2,3-dihydroxypropoxy)benzaldehyde

Names & synonyms

4-(2,3-Dihydroxypropoxy)benzaldehydeCHEMBL580214starbld0006253SCHEMBL945328QEZPUQMNWKYVDS-UHFFFAOYSA-NBDBM50378353AKOS017358942(4-(2,3-dihydroxypropoxy)phenyl)methanoneDB-331524rac-4-(2,3-dihydroxy-propoxy)-benzaldehyde

Database identifiers

PubChem CID
16655848
ChEMBL
CHEMBL580214
Nikkaji
J90.912B

Properties

Computed structural properties

XLogP
0.1
Topological polar surface area
66.8 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
14

Related reactions

9 records
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Compound notes

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