1-(9,9-diethylfluoren-2-yl)propan-1-one

C20H22O — CID 122485363

IUPAC1-(9,9-diethylfluoren-2-yl)propan-1-one
SMILESCCC(=O)c1ccc2c(c1)C(CC)(CC)c1ccccc1-2
InChIInChI=1S/C20H22O/c1-4-19(21)14-11-12-16-15-9-7-8-10-17(15)20(5-2,6-3)18(16)13-14/h7-13H,4-6H2,1-3H3
InChIKeyRYVRLBHKGNRXTE-UHFFFAOYSA-N
MW278.40 g/mol
LogP5.37
Rot. Bonds4

About 1-(9,9-diethylfluoren-2-yl)propan-1-one

1-(9,9-diethylfluoren-2-yl)propan-1-one (PubChem CID 122485363) has the molecular formula C20H22O and a molecular weight of 278.40 g/mol. Its IUPAC name is 1-(9,9-diethylfluoren-2-yl)propan-1-one.

Molecular Properties

Compound Name1-(9,9-diethylfluoren-2-yl)propan-1-one
PubChem CID122485363
Molecular FormulaC20H22O
Molecular Weight278.40 g/mol
Exact Mass278.17
IUPAC Name1-(9,9-diethylfluoren-2-yl)propan-1-one
SMILESCCC(=O)c1ccc2c(c1)C(CC)(CC)c1ccccc1-2
InChIInChI=1S/C20H22O/c1-4-19(21)14-11-12-16-15-9-7-8-10-17(15)20(5-2,6-3)18(16)13-14/h7-13H,4-6H2,1-3H3
InChIKeyRYVRLBHKGNRXTE-UHFFFAOYSA-N
XLogP5.37
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500278.40
LogP ≤ 55.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-cyclohexyl-1-(9,9-diethylfluoren-2-yl)ethanone
CID 142732979
1,3-bis(9,9-dihexylfluoren-2-yl)propane-1,3-dione
CID 141179723
[(E)-[1-(9,9-diethylfluoren-2-yl)-1-oxobutan-2-ylidene]amino] acetate
CID 177419510
9,9-diethylfluoren-2-ol
CID 163996675
1-(9,9-dipropylfluoren-2-yl)-2-phenylethanone
CID 129094188
[[1-(9,9-diethylfluoren-2-yl)-1-oxopropan-2-ylidene]amino] acetate
CID 122685051
bis(9,9-diethylfluoren-2-yl)borinic acid
CID 140671655
[(Z)-[1-(9,9-diethylfluoren-2-yl)-1-oxopropan-2-ylidene]amino] butanoate
CID 122695465
CID 173482166
CID 173482166
1-[4-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]phenyl]propan-1-one
CID 149259882
[(Z)-[1-(9,9-diethylfluoren-2-yl)-1-oxopentan-2-ylidene]amino] pentanoate
CID 122695452
[(E)-[(4Z)-4-benzoyloxyimino-4-(9,9-diethylfluoren-2-yl)-3-methylbutan-2-ylidene]amino] benzoate
CID 122485360

Frequently Asked Questions

What is the IUPAC name of 1-(9,9-diethylfluoren-2-yl)propan-1-one?
The IUPAC name of 1-(9,9-diethylfluoren-2-yl)propan-1-one (CID 122485363) is 1-(9,9-diethylfluoren-2-yl)propan-1-one.
What is the SMILES notation for 1-(9,9-diethylfluoren-2-yl)propan-1-one?
The canonical SMILES for 1-(9,9-diethylfluoren-2-yl)propan-1-one is CCC(=O)c1ccc2c(c1)C(CC)(CC)c1ccccc1-2.
What is the InChIKey of 1-(9,9-diethylfluoren-2-yl)propan-1-one?
The InChIKey is RYVRLBHKGNRXTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22O/c1-4-19(21)14-11-12-16-15-9-7-8-10-17(15)20(5-2,6-3)18(16)13-14/h7-13H,4-6H2,1-3H3.
What are the key properties of 1-(9,9-diethylfluoren-2-yl)propan-1-one?
1-(9,9-diethylfluoren-2-yl)propan-1-one has a molecular weight of 278.40 g/mol, XLogP of 5.37, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(9,9-diethylfluoren-2-yl)propan-1-one is sourced from PubChem (CID 122485363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).