2-[(4-fluorophenyl)methoxymethyl]thiophene

C12H11FOS — CID 19963315

IUPAC2-[(4-fluorophenyl)methoxymethyl]thiophene
SMILESFc1ccc(COCc2cccs2)cc1
InChIInChI=1S/C12H11FOS/c13-11-5-3-10(4-6-11)8-14-9-12-2-1-7-15-12/h1-7H,8-9H2
InChIKeyWAXQAJWEZZCLNI-UHFFFAOYSA-N
MW222.28 g/mol
LogP3.60
Rot. Bonds4

About 2-[(4-fluorophenyl)methoxymethyl]thiophene

2-[(4-fluorophenyl)methoxymethyl]thiophene (PubChem CID 19963315) has the molecular formula C12H11FOS and a molecular weight of 222.28 g/mol. Its IUPAC name is 2-[(4-fluorophenyl)methoxymethyl]thiophene.

Molecular Properties

Compound Name2-[(4-fluorophenyl)methoxymethyl]thiophene
PubChem CID19963315
Molecular FormulaC12H11FOS
Molecular Weight222.28 g/mol
Exact Mass222.05
IUPAC Name2-[(4-fluorophenyl)methoxymethyl]thiophene
SMILESFc1ccc(COCc2cccs2)cc1
InChIInChI=1S/C12H11FOS/c13-11-5-3-10(4-6-11)8-14-9-12-2-1-7-15-12/h1-7H,8-9H2
InChIKeyWAXQAJWEZZCLNI-UHFFFAOYSA-N
XLogP3.60
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.28
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-fluorophenyl)methoxymethyl]thiophene?
The IUPAC name of 2-[(4-fluorophenyl)methoxymethyl]thiophene (CID 19963315) is 2-[(4-fluorophenyl)methoxymethyl]thiophene.
What is the SMILES notation for 2-[(4-fluorophenyl)methoxymethyl]thiophene?
The canonical SMILES for 2-[(4-fluorophenyl)methoxymethyl]thiophene is Fc1ccc(COCc2cccs2)cc1.
What is the InChIKey of 2-[(4-fluorophenyl)methoxymethyl]thiophene?
The InChIKey is WAXQAJWEZZCLNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11FOS/c13-11-5-3-10(4-6-11)8-14-9-12-2-1-7-15-12/h1-7H,8-9H2.
What are the key properties of 2-[(4-fluorophenyl)methoxymethyl]thiophene?
2-[(4-fluorophenyl)methoxymethyl]thiophene has a molecular weight of 222.28 g/mol, XLogP of 3.60, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-fluorophenyl)methoxymethyl]thiophene is sourced from PubChem (CID 19963315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).