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2-[2-(Diethylamino)ethoxy]-7-[3-(diethylamino)prop-1-ynyl]fluoren-9-one (HCID 57439201)|Huagongshe
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Compound
2-[2-(Diethylamino)ethoxy]-7-[3-(diethylamino)prop-1-ynyl]fluoren-9-one
HCID
57439201
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Basic information
Names & identifiers
Properties
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Compound notes
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Basic information
Standard SMILES
CCN(CC)CC#Cc1ccc2c(c1)C(=O)c1cc(OCCN(CC)CC)ccc1-2
InChIKey
SXPWTZDPSCWTCY-UHFFFAOYSA-N
Molecular formula
C26H32N2O2
Average molar mass
404.5 g/mol
Monoisotopic mass
404.24637827
Names & identifiers
Preferred name
2-[2-(Diethylamino)ethoxy]-7-[3-(diethylamino)prop-1-ynyl]fluoren-9-one
IUPAC
2-[2-(diethylamino)ethoxy]-7-[3-(diethylamino)prop-1-ynyl]fluoren-9-one
Names & synonyms
SCHEMBL1798165
Database identifiers
PubChem CID
57439201
Properties
Computed structural properties
XLogP
4.8
Topological polar surface area
32.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
10
Heavy atoms
30
Formal charge
0
Complexity
613
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Related reactions
1 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
288152
As product
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Compound notes
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