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4-(1-Pyrrolyl)-2-indanol (HCID 13239581)|Huagongshe
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Compound
4-(1-Pyrrolyl)-2-indanol
HCID
13239581
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Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
OC1Cc2cccc(-n3cccc3)c2C1
InChIKey
RCRSSOPEIWCWPY-UHFFFAOYSA-N
Molecular formula
C13H13NO
Average molar mass
199.25 g/mol
Names & identifiers
Preferred name
4-(1-Pyrrolyl)-2-indanol
IUPAC
4-pyrrol-1-yl-2,3-dihydro-1H-inden-2-ol
Names & synonyms
4-(1-pyrrolyl)-2-indanol
SCHEMBL11083351
RCRSSOPEIWCWPY-UHFFFAOYSA-N
Database identifiers
PubChem CID
13239581
Properties
Computed structural properties
XLogP
2
Topological polar surface area
25.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
1
Heavy atoms
15
Formal charge
0
Complexity
225
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Related reactions
4 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
167460
As product
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID
325781
As product
uspto-grants-1984_04
HRID
647318
As product
uspto-grants-1983_10
HRID
1164210
As product
uspto-grants-1983_01
Compound notes
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