2-(2-chlorophenoxy)-1-(9H-fluoren-3-yl)ethanone

C21H15ClO2 — CID 2121351

IUPAC2-(2-chlorophenoxy)-1-(9H-fluoren-3-yl)ethanone
SMILESO=C(COc1ccccc1Cl)c1ccc2c(c1)-c1ccccc1C2
InChIInChI=1S/C21H15ClO2/c22-19-7-3-4-8-21(19)24-13-20(23)16-10-9-15-11-14-5-1-2-6-17(14)18(15)12-16/h1-10,12H,11,13H2
InChIKeyITPRJFDAJMRVPY-UHFFFAOYSA-N
MW334.80 g/mol
LogP5.17
Rot. Bonds4

About 2-(2-chlorophenoxy)-1-(9H-fluoren-3-yl)ethanone

2-(2-chlorophenoxy)-1-(9H-fluoren-3-yl)ethanone (PubChem CID 2121351) has the molecular formula C21H15ClO2 and a molecular weight of 334.80 g/mol. Its IUPAC name is 2-(2-chlorophenoxy)-1-(9H-fluoren-3-yl)ethanone.

Molecular Properties

Compound Name2-(2-chlorophenoxy)-1-(9H-fluoren-3-yl)ethanone
PubChem CID2121351
Molecular FormulaC21H15ClO2
Molecular Weight334.80 g/mol
Exact Mass334.08
IUPAC Name2-(2-chlorophenoxy)-1-(9H-fluoren-3-yl)ethanone
SMILESO=C(COc1ccccc1Cl)c1ccc2c(c1)-c1ccccc1C2
InChIInChI=1S/C21H15ClO2/c22-19-7-3-4-8-21(19)24-13-20(23)16-10-9-15-11-14-5-1-2-6-17(14)18(15)12-16/h1-10,12H,11,13H2
InChIKeyITPRJFDAJMRVPY-UHFFFAOYSA-N
XLogP5.17
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500334.80
LogP ≤ 55.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

[2-(9H-fluoren-3-yl)-2-oxoethyl] 2,6-dichlorobenzoate
CID 7723570
[2-(9H-fluoren-3-yl)-2-oxoethyl] 2-chloro-4-fluorobenzoate
CID 7825922
1-(3-bromophenyl)-2-(2-chlorophenoxy)ethanone
CID 60625595
[2-(9H-fluoren-3-yl)-2-oxoethyl] 4-(hydroxymethyl)benzoate
CID 7502110
[2-(9H-fluoren-3-yl)-2-oxoethyl] 2-(2-methylphenyl)acetate
CID 7489133
[2-(9H-fluoren-3-yl)-2-oxoethyl] 3-methoxy-4-propoxybenzoate
CID 2095942
[2-(9H-fluoren-3-yl)-2-oxoethyl] 2-(4-tert-butylphenoxy)acetate
CID 7855454
[2-(9H-fluoren-3-yl)-2-oxoethyl] 3-(4-methylphenoxy)propanoate
CID 2438123
1-(9H-fluoren-2-yl)-3-phenylpropane-1,3-dione
CID 132527641
[2-(9H-fluoren-3-yl)-2-oxoethyl] 4-methoxy-3-pyrrolidin-1-ylsulfonylbenzoate
CID 2102172
[2-(9H-fluoren-3-yl)-2-oxoethyl] 3-cyanobenzoate
CID 29183065
1-(9H-fluoren-3-yl)-2-(2,3,4,5,6-pentafluorophenyl)sulfanylethanone
CID 7467328

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenoxy)-1-(9H-fluoren-3-yl)ethanone?
The IUPAC name of 2-(2-chlorophenoxy)-1-(9H-fluoren-3-yl)ethanone (CID 2121351) is 2-(2-chlorophenoxy)-1-(9H-fluoren-3-yl)ethanone.
What is the SMILES notation for 2-(2-chlorophenoxy)-1-(9H-fluoren-3-yl)ethanone?
The canonical SMILES for 2-(2-chlorophenoxy)-1-(9H-fluoren-3-yl)ethanone is O=C(COc1ccccc1Cl)c1ccc2c(c1)-c1ccccc1C2.
What is the InChIKey of 2-(2-chlorophenoxy)-1-(9H-fluoren-3-yl)ethanone?
The InChIKey is ITPRJFDAJMRVPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15ClO2/c22-19-7-3-4-8-21(19)24-13-20(23)16-10-9-15-11-14-5-1-2-6-17(14)18(15)12-16/h1-10,12H,11,13H2.
What are the key properties of 2-(2-chlorophenoxy)-1-(9H-fluoren-3-yl)ethanone?
2-(2-chlorophenoxy)-1-(9H-fluoren-3-yl)ethanone has a molecular weight of 334.80 g/mol, XLogP of 5.17, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenoxy)-1-(9H-fluoren-3-yl)ethanone is sourced from PubChem (CID 2121351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).