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4-(2-Thienyl)-1-indanol (HCID 13102460)|Huagongshe
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Compound
4-(2-Thienyl)-1-indanol
HCID
13102460
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Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
OC1CCc2c(-c3cccs3)cccc21
InChIKey
YBGFAAKUUIZVHS-UHFFFAOYSA-N
Molecular formula
C13H12OS
Average molar mass
216.3 g/mol
Names & identifiers
Preferred name
4-(2-Thienyl)-1-indanol
IUPAC
4-thiophen-2-yl-2,3-dihydro-1H-inden-1-ol
Names & synonyms
4-(2-thienyl)-1-indanol
SCHEMBL11077815
YBGFAAKUUIZVHS-UHFFFAOYSA-N
Database identifiers
PubChem CID
13102460
Properties
Computed structural properties
XLogP
2.8
Topological polar surface area
48.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
15
Formal charge
0
Complexity
231
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Related reactions
8 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
152503
As product
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID
284740
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID
325777
As product
uspto-grants-1984_04
HRID
325778
As reactant
uspto-grants-1984_04
HRID
647314
As product
uspto-grants-1983_10
HRID
647315
As reactant
uspto-grants-1983_10
HRID
1164206
As product
uspto-grants-1983_01
HRID
1164207
As reactant
uspto-grants-1983_01
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Compound notes
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