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7-Methoxy-4-hydroxyindan-1-one (HCID 20545946)|Huagongshe
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Compound
7-Methoxy-4-hydroxyindan-1-one
HCID
20545946
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Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
COc1ccc(O)c2c1C(=O)CC2
InChIKey
VCBRZKGKGDTWOR-UHFFFAOYSA-N
Molecular formula
C10H10O3
Average molar mass
178.18 g/mol
Names & identifiers
Preferred name
7-Methoxy-4-hydroxyindan-1-one
IUPAC
4-hydroxy-7-methoxy-2,3-dihydroinden-1-one
Names & synonyms
SCHEMBL11245366
7-methoxy-4-hydroxyindan-1-one
VCBRZKGKGDTWOR-UHFFFAOYSA-N
Database identifiers
PubChem CID
20545946
Properties
Computed structural properties
XLogP
1.3
Topological polar surface area
46.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
13
Formal charge
0
Complexity
214
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Related reactions
2 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
817135
As reactant
Test data from https://doi.org/10.1039/C8SC04228D
HRID
2059183
As reactant
uspto-grants-1982_03
Compound notes
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