(4-ethoxy-3-fluorophenyl)methanol

C9H11FO2 — CID 28945847

IUPAC(4-ethoxy-3-fluorophenyl)methanol
SMILESCCOc1ccc(CO)cc1F
InChIInChI=1S/C9H11FO2/c1-2-12-9-4-3-7(6-11)5-8(9)10/h3-5,11H,2,6H2,1H3
InChIKeyNUFQHDWXIUIIFK-UHFFFAOYSA-N
MW170.18 g/mol
LogP1.72
Rot. Bonds3

About (4-ethoxy-3-fluorophenyl)methanol

(4-ethoxy-3-fluorophenyl)methanol (PubChem CID 28945847) has the molecular formula C9H11FO2 and a molecular weight of 170.18 g/mol. Its IUPAC name is (4-ethoxy-3-fluorophenyl)methanol.

Molecular Properties

Compound Name(4-ethoxy-3-fluorophenyl)methanol
PubChem CID28945847
Molecular FormulaC9H11FO2
Molecular Weight170.18 g/mol
Exact Mass170.07
IUPAC Name(4-ethoxy-3-fluorophenyl)methanol
SMILESCCOc1ccc(CO)cc1F
InChIInChI=1S/C9H11FO2/c1-2-12-9-4-3-7(6-11)5-8(9)10/h3-5,11H,2,6H2,1H3
InChIKeyNUFQHDWXIUIIFK-UHFFFAOYSA-N
XLogP1.72
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.18
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4-ethoxy-3-fluorophenyl)methanol?
The IUPAC name of (4-ethoxy-3-fluorophenyl)methanol (CID 28945847) is (4-ethoxy-3-fluorophenyl)methanol.
What is the SMILES notation for (4-ethoxy-3-fluorophenyl)methanol?
The canonical SMILES for (4-ethoxy-3-fluorophenyl)methanol is CCOc1ccc(CO)cc1F.
What is the InChIKey of (4-ethoxy-3-fluorophenyl)methanol?
The InChIKey is NUFQHDWXIUIIFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11FO2/c1-2-12-9-4-3-7(6-11)5-8(9)10/h3-5,11H,2,6H2,1H3.
What are the key properties of (4-ethoxy-3-fluorophenyl)methanol?
(4-ethoxy-3-fluorophenyl)methanol has a molecular weight of 170.18 g/mol, XLogP of 1.72, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethoxy-3-fluorophenyl)methanol is sourced from PubChem (CID 28945847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).