fluoren-1-one;1-phenylethanone

C21H16O2 — CID 121282266

IUPACfluoren-1-one;1-phenylethanone
SMILESCC(=O)c1ccccc1.O=C1C=CC=C2C1=Cc1ccccc12
InChIInChI=1S/C13H8O.C8H8O/c14-13-7-3-6-11-10-5-2-1-4-9(10)8-12(11)13;1-7(9)8-5-3-2-4-6-8/h1-8H;2-6H,1H3
InChIKeyCAYDXRWCTAIBQP-UHFFFAOYSA-N
MW300.36 g/mol
LogP4.50
Rot. Bonds1

About fluoren-1-one;1-phenylethanone

fluoren-1-one;1-phenylethanone (PubChem CID 121282266) has the molecular formula C21H16O2 and a molecular weight of 300.36 g/mol. Its IUPAC name is fluoren-1-one;1-phenylethanone.

Molecular Properties

Compound Namefluoren-1-one;1-phenylethanone
PubChem CID121282266
Molecular FormulaC21H16O2
Molecular Weight300.36 g/mol
Exact Mass300.12
IUPAC Namefluoren-1-one;1-phenylethanone
SMILESCC(=O)c1ccccc1.O=C1C=CC=C2C1=Cc1ccccc12
InChIInChI=1S/C13H8O.C8H8O/c14-13-7-3-6-11-10-5-2-1-4-9(10)8-12(11)13;1-7(9)8-5-3-2-4-6-8/h1-8H;2-6H,1H3
InChIKeyCAYDXRWCTAIBQP-UHFFFAOYSA-N
XLogP4.50
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 54.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of fluoren-1-one;1-phenylethanone?
The IUPAC name of fluoren-1-one;1-phenylethanone (CID 121282266) is fluoren-1-one;1-phenylethanone.
What is the SMILES notation for fluoren-1-one;1-phenylethanone?
The canonical SMILES for fluoren-1-one;1-phenylethanone is CC(=O)c1ccccc1.O=C1C=CC=C2C1=Cc1ccccc12.
What is the InChIKey of fluoren-1-one;1-phenylethanone?
The InChIKey is CAYDXRWCTAIBQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8O.C8H8O/c14-13-7-3-6-11-10-5-2-1-4-9(10)8-12(11)13;1-7(9)8-5-3-2-4-6-8/h1-8H;2-6H,1H3.
What are the key properties of fluoren-1-one;1-phenylethanone?
fluoren-1-one;1-phenylethanone has a molecular weight of 300.36 g/mol, XLogP of 4.50, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for fluoren-1-one;1-phenylethanone is sourced from PubChem (CID 121282266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).