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2-Chloro-3-benzyloxy-4-hydroxybenzaldehyde

HCID 20196371
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
O=Cc1ccc(O)c(OCc2ccccc2)c1Cl
InChIKey
WIVYUFNBTYBNRE-UHFFFAOYSA-N
Molecular formula
C14H11ClO3
Average molar mass
262.69 g/mol

Names & identifiers

Preferred name
2-Chloro-3-benzyloxy-4-hydroxybenzaldehyde
IUPAC
2-chloro-4-hydroxy-3-phenylmethoxybenzaldehyde

Names & synonyms

SCHEMBL10605128WIVYUFNBTYBNRE-UHFFFAOYSA-N2-chloro-3-benzyloxy-4-hydroxybenzaldehyde

Database identifiers

PubChem CID
20196371

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
46.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
18
Formal charge
0
Complexity
266

Related reactions

3 records
New reaction record
HRID 104701 reaction equation
HRID 104701As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 652803 reaction equation
HRID 652803As productuspto-grants-1987_06
HRID 652804 reaction equation
HRID 652804As reactantuspto-grants-1987_06

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes