4-(difluoromethoxy)-1,3-thiazole

C4H3F2NOS — CID 91182582

IUPAC4-(difluoromethoxy)-1,3-thiazole
SMILESFC(F)Oc1cscn1
InChIInChI=1S/C4H3F2NOS/c5-4(6)8-3-1-9-2-7-3/h1-2,4H
InChIKeyQUQKNEBGGCLRRD-UHFFFAOYSA-N
MW151.14 g/mol
LogP1.74
Rot. Bonds2

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

4-(difluoromethoxy)-1,3-thiazole (PubChem CID 91182582) has the molecular formula C4H3F2NOS and a molecular weight of 151.14 g/mol. Its IUPAC name is 4-(difluoromethoxy)-1,3-thiazole.

Molecular Properties

Compound Name4-(difluoromethoxy)-1,3-thiazole
PubChem CID91182582
Molecular FormulaC4H3F2NOS
Molecular Weight151.14 g/mol
Exact Mass150.99
IUPAC Name4-(difluoromethoxy)-1,3-thiazole
SMILESFC(F)Oc1cscn1
InChIInChI=1S/C4H3F2NOS/c5-4(6)8-3-1-9-2-7-3/h1-2,4H
InChIKeyQUQKNEBGGCLRRD-UHFFFAOYSA-N
XLogP1.74
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.14
LogP ≤ 51.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(difluoromethoxy)-1,3-thiazole?
The IUPAC name of 4-(difluoromethoxy)-1,3-thiazole (CID 91182582) is 4-(difluoromethoxy)-1,3-thiazole.
What is the SMILES notation for 4-(difluoromethoxy)-1,3-thiazole?
The canonical SMILES for 4-(difluoromethoxy)-1,3-thiazole is FC(F)Oc1cscn1.
What is the InChIKey of 4-(difluoromethoxy)-1,3-thiazole?
The InChIKey is QUQKNEBGGCLRRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H3F2NOS/c5-4(6)8-3-1-9-2-7-3/h1-2,4H.
What are the key properties of 4-(difluoromethoxy)-1,3-thiazole?
4-(difluoromethoxy)-1,3-thiazole has a molecular weight of 151.14 g/mol, XLogP of 1.74, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(difluoromethoxy)-1,3-thiazole is sourced from PubChem (CID 91182582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).