1-[2-(4-chlorophenyl)phenyl]fluoren-9-one

C25H15ClO — CID 130380105

IUPAC1-[2-(4-chlorophenyl)phenyl]fluoren-9-one
SMILESO=C1c2ccccc2-c2cccc(-c3ccccc3-c3ccc(Cl)cc3)c21
InChIInChI=1S/C25H15ClO/c26-17-14-12-16(13-15-17)18-6-1-2-7-19(18)21-10-5-11-22-20-8-3-4-9-23(20)25(27)24(21)22/h1-15H
InChIKeyNJBSBQFWIQJLEB-UHFFFAOYSA-N
MW366.85 g/mol
LogP6.89
Rot. Bonds2

About 1-[2-(4-chlorophenyl)phenyl]fluoren-9-one

1-[2-(4-chlorophenyl)phenyl]fluoren-9-one (PubChem CID 130380105) has the molecular formula C25H15ClO and a molecular weight of 366.85 g/mol. Its IUPAC name is 1-[2-(4-chlorophenyl)phenyl]fluoren-9-one.

Molecular Properties

Compound Name1-[2-(4-chlorophenyl)phenyl]fluoren-9-one
PubChem CID130380105
Molecular FormulaC25H15ClO
Molecular Weight366.85 g/mol
Exact Mass366.08
IUPAC Name1-[2-(4-chlorophenyl)phenyl]fluoren-9-one
SMILESO=C1c2ccccc2-c2cccc(-c3ccccc3-c3ccc(Cl)cc3)c21
InChIInChI=1S/C25H15ClO/c26-17-14-12-16(13-15-17)18-6-1-2-7-19(18)21-10-5-11-22-20-8-3-4-9-23(20)25(27)24(21)22/h1-15H
InChIKeyNJBSBQFWIQJLEB-UHFFFAOYSA-N
XLogP6.89
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.85
LogP ≤ 56.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-chlorophenyl)phenyl]fluoren-9-one?
The IUPAC name of 1-[2-(4-chlorophenyl)phenyl]fluoren-9-one (CID 130380105) is 1-[2-(4-chlorophenyl)phenyl]fluoren-9-one.
What is the SMILES notation for 1-[2-(4-chlorophenyl)phenyl]fluoren-9-one?
The canonical SMILES for 1-[2-(4-chlorophenyl)phenyl]fluoren-9-one is O=C1c2ccccc2-c2cccc(-c3ccccc3-c3ccc(Cl)cc3)c21.
What is the InChIKey of 1-[2-(4-chlorophenyl)phenyl]fluoren-9-one?
The InChIKey is NJBSBQFWIQJLEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H15ClO/c26-17-14-12-16(13-15-17)18-6-1-2-7-19(18)21-10-5-11-22-20-8-3-4-9-23(20)25(27)24(21)22/h1-15H.
What are the key properties of 1-[2-(4-chlorophenyl)phenyl]fluoren-9-one?
1-[2-(4-chlorophenyl)phenyl]fluoren-9-one has a molecular weight of 366.85 g/mol, XLogP of 6.89, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-chlorophenyl)phenyl]fluoren-9-one is sourced from PubChem (CID 130380105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).