1-(fluoromethoxy)-4-methoxybenzene

C8H9FO2 — CID 15271080

IUPAC1-(fluoromethoxy)-4-methoxybenzene
SMILESCOc1ccc(OCF)cc1
InChIInChI=1S/C8H9FO2/c1-10-7-2-4-8(5-3-7)11-6-9/h2-5H,6H2,1H3
InChIKeyASGIRHWZQLUCOC-UHFFFAOYSA-N
MW156.16 g/mol
LogP2.00
Rot. Bonds3

About 1-(fluoromethoxy)-4-methoxybenzene

1-(fluoromethoxy)-4-methoxybenzene (PubChem CID 15271080) has the molecular formula C8H9FO2 and a molecular weight of 156.16 g/mol. Its IUPAC name is 1-(fluoromethoxy)-4-methoxybenzene.

Molecular Properties

Compound Name1-(fluoromethoxy)-4-methoxybenzene
PubChem CID15271080
Molecular FormulaC8H9FO2
Molecular Weight156.16 g/mol
Exact Mass156.06
IUPAC Name1-(fluoromethoxy)-4-methoxybenzene
SMILESCOc1ccc(OCF)cc1
InChIInChI=1S/C8H9FO2/c1-10-7-2-4-8(5-3-7)11-6-9/h2-5H,6H2,1H3
InChIKeyASGIRHWZQLUCOC-UHFFFAOYSA-N
XLogP2.00
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.16
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(fluoromethoxy)-4-methoxybenzene?
The IUPAC name of 1-(fluoromethoxy)-4-methoxybenzene (CID 15271080) is 1-(fluoromethoxy)-4-methoxybenzene.
What is the SMILES notation for 1-(fluoromethoxy)-4-methoxybenzene?
The canonical SMILES for 1-(fluoromethoxy)-4-methoxybenzene is COc1ccc(OCF)cc1.
What is the InChIKey of 1-(fluoromethoxy)-4-methoxybenzene?
The InChIKey is ASGIRHWZQLUCOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9FO2/c1-10-7-2-4-8(5-3-7)11-6-9/h2-5H,6H2,1H3.
What are the key properties of 1-(fluoromethoxy)-4-methoxybenzene?
1-(fluoromethoxy)-4-methoxybenzene has a molecular weight of 156.16 g/mol, XLogP of 2.00, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(fluoromethoxy)-4-methoxybenzene is sourced from PubChem (CID 15271080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).