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7-(2-thienyl)-1H-indene (HCID 13102462)|Huagongshe
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Compound
7-(2-thienyl)-1H-indene
HCID
13102462
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Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
C1=Cc2cccc(-c3cccs3)c2C1
InChIKey
XEQDMHWDQGBJCR-UHFFFAOYSA-N
Molecular formula
C13H10S
Average molar mass
198.29 g/mol
Names & identifiers
Preferred name
7-(2-thienyl)-1H-indene
IUPAC
2-(3H-inden-4-yl)thiophene
Names & synonyms
7-(2-thienyl)-1H-indene
SCHEMBL11084798
XEQDMHWDQGBJCR-UHFFFAOYSA-N
Database identifiers
PubChem CID
13102462
Properties
Computed structural properties
XLogP
4.1
Topological polar surface area
28.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
1
Heavy atoms
14
Formal charge
0
Complexity
233
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Related reactions
4 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
284740
As product
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID
325778
As product
uspto-grants-1984_04
HRID
647315
As product
uspto-grants-1983_10
HRID
1164207
As product
uspto-grants-1983_01
Compound notes
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