2-Chloro-4,5-dihydroxymandelic acid

HCID 20189977
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Basic information

Standard SMILES
O=C(O)C(O)c1cc(O)c(O)cc1Cl
InChIKey
FSSCIXLJZTTYGK-UHFFFAOYSA-N
Molecular formula
C8H7ClO5
Average molar mass
218.59 g/mol

Names & identifiers

Preferred name
2-Chloro-4,5-dihydroxymandelic acid
IUPAC
2-(2-chloro-4,5-dihydroxyphenyl)-2-hydroxyacetic acid

Names & synonyms

SCHEMBL10595878FSSCIXLJZTTYGK-UHFFFAOYSA-N2-Chloro-4,5-dihydroxymandelic acid

Database identifiers

PubChem CID
20189977

Properties

Computed structural properties

XLogP
0.7
Topological polar surface area
98 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
5
Rotatable bonds
2
Heavy atoms
14

Related reactions

1 records
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Compound notes

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