2-chlorofluoren-9-one

C13H7ClO — CID 18354

IUPAC2-chlorofluoren-9-one
SMILESO=C1c2ccccc2-c2ccc(Cl)cc21
InChIInChI=1S/C13H7ClO/c14-8-5-6-10-9-3-1-2-4-11(9)13(15)12(10)7-8/h1-7H
InChIKeyRBPGISZOPGTNMV-UHFFFAOYSA-N
MW214.65 g/mol
LogP3.55
Rot. Bonds

About 2-chlorofluoren-9-one

2-chlorofluoren-9-one (PubChem CID 18354) has the molecular formula C13H7ClO and a molecular weight of 214.65 g/mol. Its IUPAC name is 2-chlorofluoren-9-one.

Molecular Properties

Compound Name2-chlorofluoren-9-one
PubChem CID18354
Molecular FormulaC13H7ClO
Molecular Weight214.65 g/mol
Exact Mass214.02
IUPAC Name2-chlorofluoren-9-one
SMILESO=C1c2ccccc2-c2ccc(Cl)cc21
InChIInChI=1S/C13H7ClO/c14-8-5-6-10-9-3-1-2-4-11(9)13(15)12(10)7-8/h1-7H
InChIKeyRBPGISZOPGTNMV-UHFFFAOYSA-N
XLogP3.55
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.65
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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3'-Chlorochalcone
CID 639084
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Frequently Asked Questions

What is the IUPAC name of 2-chlorofluoren-9-one?
The IUPAC name of 2-chlorofluoren-9-one (CID 18354) is 2-chlorofluoren-9-one.
What is the SMILES notation for 2-chlorofluoren-9-one?
The canonical SMILES for 2-chlorofluoren-9-one is O=C1c2ccccc2-c2ccc(Cl)cc21.
What is the InChIKey of 2-chlorofluoren-9-one?
The InChIKey is RBPGISZOPGTNMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H7ClO/c14-8-5-6-10-9-3-1-2-4-11(9)13(15)12(10)7-8/h1-7H.
What are the key properties of 2-chlorofluoren-9-one?
2-chlorofluoren-9-one has a molecular weight of 214.65 g/mol, XLogP of 3.55, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chlorofluoren-9-one is sourced from PubChem (CID 18354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).