2-fluoro-1-(2-methoxyphenyl)ethanone

C9H9FO2 — CID 11816076

IUPAC2-fluoro-1-(2-methoxyphenyl)ethanone
SMILESCOc1ccccc1C(=O)CF
InChIInChI=1S/C9H9FO2/c1-12-9-5-3-2-4-7(9)8(11)6-10/h2-5H,6H2,1H3
InChIKeyQYFIWKFQTBFJKD-UHFFFAOYSA-N
MW168.17 g/mol
LogP1.85
Rot. Bonds3

About 2-fluoro-1-(2-methoxyphenyl)ethanone

2-fluoro-1-(2-methoxyphenyl)ethanone (PubChem CID 11816076) has the molecular formula C9H9FO2 and a molecular weight of 168.17 g/mol. Its IUPAC name is 2-fluoro-1-(2-methoxyphenyl)ethanone.

Molecular Properties

Compound Name2-fluoro-1-(2-methoxyphenyl)ethanone
PubChem CID11816076
Molecular FormulaC9H9FO2
Molecular Weight168.17 g/mol
Exact Mass168.06
IUPAC Name2-fluoro-1-(2-methoxyphenyl)ethanone
SMILESCOc1ccccc1C(=O)CF
InChIInChI=1S/C9H9FO2/c1-12-9-5-3-2-4-7(9)8(11)6-10/h2-5H,6H2,1H3
InChIKeyQYFIWKFQTBFJKD-UHFFFAOYSA-N
XLogP1.85
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.17
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,3-bis(2-methoxyphenyl)propane-1,3-dione
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[2-(2-methoxyphenyl)-2-oxoethyl] 2-methoxybenzoate
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3-amino-1-(2-methoxyphenyl)-3-methylbutan-1-one
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N-[2-(2-methoxyphenyl)-2-oxoethyl]acetamide
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CID 78908110
2-[4-[2-(2-methoxyphenyl)-2-oxoethyl]phenyl]acetic acid
CID 158147821
N-formyl-N-[2-(2-methoxyphenyl)-2-oxoethyl]formamide
CID 86593207
3-(2-methoxyphenyl)-3-oxopropane-1-sulfonic acid
CID 94688299
1-(2-methoxyphenyl)undecan-1-one
CID 63411736
2-methoxybenzoyl iodide
CID 139677083
CID 135043978
CID 135043978

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-1-(2-methoxyphenyl)ethanone?
The IUPAC name of 2-fluoro-1-(2-methoxyphenyl)ethanone (CID 11816076) is 2-fluoro-1-(2-methoxyphenyl)ethanone.
What is the SMILES notation for 2-fluoro-1-(2-methoxyphenyl)ethanone?
The canonical SMILES for 2-fluoro-1-(2-methoxyphenyl)ethanone is COc1ccccc1C(=O)CF.
What is the InChIKey of 2-fluoro-1-(2-methoxyphenyl)ethanone?
The InChIKey is QYFIWKFQTBFJKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9FO2/c1-12-9-5-3-2-4-7(9)8(11)6-10/h2-5H,6H2,1H3.
What are the key properties of 2-fluoro-1-(2-methoxyphenyl)ethanone?
2-fluoro-1-(2-methoxyphenyl)ethanone has a molecular weight of 168.17 g/mol, XLogP of 1.85, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-1-(2-methoxyphenyl)ethanone is sourced from PubChem (CID 11816076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).