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8-Methyl-2-phenylchroman-7-ol (HCID 14224896)|Huagongshe
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Compound
8-Methyl-2-phenylchroman-7-ol
HCID
14224896
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Notes
Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
Cc1c(O)ccc2c1OC(c1ccccc1)CC2
InChIKey
DPJLQIOUHFJLAT-UHFFFAOYSA-N
Molecular formula
C16H16O2
Average molar mass
240.3 g/mol
Names & identifiers
Preferred name
8-Methyl-2-phenylchroman-7-ol
IUPAC
8-methyl-2-phenyl-3,4-dihydro-2H-chromen-7-ol
Names & synonyms
8-methyl-2-phenylchroman-7-ol
SCHEMBL148255
DPJLQIOUHFJLAT-UHFFFAOYSA-N
Database identifiers
PubChem CID
14224896
Properties
Computed structural properties
XLogP
3.8
Topological polar surface area
29.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
18
Formal charge
0
Complexity
272
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Related reactions
6 records
New reaction record
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
661840
As product
uspto-grants-2011_12
HRID
661841
As reactant
uspto-grants-2011_12
HRID
698712
As product
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID
834708
As reactant
Test data from https://doi.org/10.1039/C8SC04228D
HRID
1811020
As product
uspto-grants-2013_01
HRID
1811021
As reactant
uspto-grants-2013_01
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Compound notes
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