[4-(ethoxymethyl)-2,3,5,6-tetrafluorophenyl]methanol

C10H10F4O2 — CID 14718895

IUPAC[4-(ethoxymethyl)-2,3,5,6-tetrafluorophenyl]methanol
SMILESCCOCc1c(F)c(F)c(CO)c(F)c1F
InChIInChI=1S/C10H10F4O2/c1-2-16-4-6-9(13)7(11)5(3-15)8(12)10(6)14/h15H,2-4H2,1H3
InChIKeyWAGFTFMRDQMPLQ-UHFFFAOYSA-N
MW238.18 g/mol
LogP2.27
Rot. Bonds4

About [4-(ethoxymethyl)-2,3,5,6-tetrafluorophenyl]methanol

[4-(ethoxymethyl)-2,3,5,6-tetrafluorophenyl]methanol (PubChem CID 14718895) has the molecular formula C10H10F4O2 and a molecular weight of 238.18 g/mol. Its IUPAC name is [4-(ethoxymethyl)-2,3,5,6-tetrafluorophenyl]methanol.

Molecular Properties

Compound Name[4-(ethoxymethyl)-2,3,5,6-tetrafluorophenyl]methanol
PubChem CID14718895
Molecular FormulaC10H10F4O2
Molecular Weight238.18 g/mol
Exact Mass238.06
IUPAC Name[4-(ethoxymethyl)-2,3,5,6-tetrafluorophenyl]methanol
SMILESCCOCc1c(F)c(F)c(CO)c(F)c1F
InChIInChI=1S/C10H10F4O2/c1-2-16-4-6-9(13)7(11)5(3-15)8(12)10(6)14/h15H,2-4H2,1H3
InChIKeyWAGFTFMRDQMPLQ-UHFFFAOYSA-N
XLogP2.27
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.18
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [4-(ethoxymethyl)-2,3,5,6-tetrafluorophenyl]methanol?
The IUPAC name of [4-(ethoxymethyl)-2,3,5,6-tetrafluorophenyl]methanol (CID 14718895) is [4-(ethoxymethyl)-2,3,5,6-tetrafluorophenyl]methanol.
What is the SMILES notation for [4-(ethoxymethyl)-2,3,5,6-tetrafluorophenyl]methanol?
The canonical SMILES for [4-(ethoxymethyl)-2,3,5,6-tetrafluorophenyl]methanol is CCOCc1c(F)c(F)c(CO)c(F)c1F.
What is the InChIKey of [4-(ethoxymethyl)-2,3,5,6-tetrafluorophenyl]methanol?
The InChIKey is WAGFTFMRDQMPLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F4O2/c1-2-16-4-6-9(13)7(11)5(3-15)8(12)10(6)14/h15H,2-4H2,1H3.
What are the key properties of [4-(ethoxymethyl)-2,3,5,6-tetrafluorophenyl]methanol?
[4-(ethoxymethyl)-2,3,5,6-tetrafluorophenyl]methanol has a molecular weight of 238.18 g/mol, XLogP of 2.27, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(ethoxymethyl)-2,3,5,6-tetrafluorophenyl]methanol is sourced from PubChem (CID 14718895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).