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1,1-Dicyclopropyl-2-dibenzylamino-ethanol (HCID 68798285)|Huagongshe
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Compound
1,1-Dicyclopropyl-2-dibenzylamino-ethanol
HCID
68798285
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Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
OC(CN(Cc1ccccc1)Cc1ccccc1)(C1CC1)C1CC1
InChIKey
ZFKJVEKTVDQFML-UHFFFAOYSA-N
Molecular formula
C22H27NO
Average molar mass
321.5 g/mol
Names & identifiers
Preferred name
1,1-Dicyclopropyl-2-dibenzylamino-ethanol
IUPAC
1,1-dicyclopropyl-2-(dibenzylamino)ethanol
Names & synonyms
SCHEMBL3812124
ZFKJVEKTVDQFML-UHFFFAOYSA-N
1,1-Dicyclopropyl-2-dibenzylamino-ethanol
Database identifiers
PubChem CID
68798285
Properties
Computed structural properties
XLogP
3.9
Topological polar surface area
23.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
8
Heavy atoms
24
Formal charge
0
Complexity
357
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Related reactions
3 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
93691
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID
1865892
As product
uspto-grants-2009_12
HRID
1865893
As reactant
uspto-grants-2009_12
Compound notes
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