2-(difluoromethoxy)-4-ethyl-1,3-thiazole

C6H7F2NOS — CID 67808774

IUPAC2-(difluoromethoxy)-4-ethyl-1,3-thiazole
SMILESCCc1csc(OC(F)F)n1
InChIInChI=1S/C6H7F2NOS/c1-2-4-3-11-6(9-4)10-5(7)8/h3,5H,2H2,1H3
InChIKeyUOMOSCYUBRCQRP-UHFFFAOYSA-N
MW179.19 g/mol
LogP2.31
Rot. Bonds3

About 2-(difluoromethoxy)-4-ethyl-1,3-thiazole

2-(difluoromethoxy)-4-ethyl-1,3-thiazole (PubChem CID 67808774) has the molecular formula C6H7F2NOS and a molecular weight of 179.19 g/mol. Its IUPAC name is 2-(difluoromethoxy)-4-ethyl-1,3-thiazole.

Molecular Properties

Compound Name2-(difluoromethoxy)-4-ethyl-1,3-thiazole
PubChem CID67808774
Molecular FormulaC6H7F2NOS
Molecular Weight179.19 g/mol
Exact Mass179.02
IUPAC Name2-(difluoromethoxy)-4-ethyl-1,3-thiazole
SMILESCCc1csc(OC(F)F)n1
InChIInChI=1S/C6H7F2NOS/c1-2-4-3-11-6(9-4)10-5(7)8/h3,5H,2H2,1H3
InChIKeyUOMOSCYUBRCQRP-UHFFFAOYSA-N
XLogP2.31
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.19
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethoxy)-4-ethyl-1,3-thiazole?
The IUPAC name of 2-(difluoromethoxy)-4-ethyl-1,3-thiazole (CID 67808774) is 2-(difluoromethoxy)-4-ethyl-1,3-thiazole.
What is the SMILES notation for 2-(difluoromethoxy)-4-ethyl-1,3-thiazole?
The canonical SMILES for 2-(difluoromethoxy)-4-ethyl-1,3-thiazole is CCc1csc(OC(F)F)n1.
What is the InChIKey of 2-(difluoromethoxy)-4-ethyl-1,3-thiazole?
The InChIKey is UOMOSCYUBRCQRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7F2NOS/c1-2-4-3-11-6(9-4)10-5(7)8/h3,5H,2H2,1H3.
What are the key properties of 2-(difluoromethoxy)-4-ethyl-1,3-thiazole?
2-(difluoromethoxy)-4-ethyl-1,3-thiazole has a molecular weight of 179.19 g/mol, XLogP of 2.31, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethoxy)-4-ethyl-1,3-thiazole is sourced from PubChem (CID 67808774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).