4-fluoro-2-(1,3-thiazol-4-yl)phenol

C9H6FNOS — CID 97033771

IUPAC4-fluoro-2-(1,3-thiazol-4-yl)phenol
SMILESOc1ccc(F)cc1-c1cscn1
InChIInChI=1S/C9H6FNOS/c10-6-1-2-9(12)7(3-6)8-4-13-5-11-8/h1-5,12H
InChIKeyFRNRLTSGOQVABL-UHFFFAOYSA-N
MW195.22 g/mol
LogP2.65
Rot. Bonds1

About 4-fluoro-2-(1,3-thiazol-4-yl)phenol

4-fluoro-2-(1,3-thiazol-4-yl)phenol (PubChem CID 97033771) has the molecular formula C9H6FNOS and a molecular weight of 195.22 g/mol. Its IUPAC name is 4-fluoro-2-(1,3-thiazol-4-yl)phenol.

Molecular Properties

Compound Name4-fluoro-2-(1,3-thiazol-4-yl)phenol
PubChem CID97033771
Molecular FormulaC9H6FNOS
Molecular Weight195.22 g/mol
Exact Mass195.02
IUPAC Name4-fluoro-2-(1,3-thiazol-4-yl)phenol
SMILESOc1ccc(F)cc1-c1cscn1
InChIInChI=1S/C9H6FNOS/c10-6-1-2-9(12)7(3-6)8-4-13-5-11-8/h1-5,12H
InChIKeyFRNRLTSGOQVABL-UHFFFAOYSA-N
XLogP2.65
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(5-fluoro-2-methoxyphenyl)-1,3-thiazole
CID 4984858
4-(4-fluoro-2-methoxyphenyl)-1,3-thiazole
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2-[4-(1,3-thiazol-4-yl)-1,3-thiazol-2-yl]phenol
CID 136930256
6-(4-fluoro-2-hydroxyphenyl)pyridin-3-ol
CID 135741749
1-[3-fluoro-4-(1,3-thiazol-4-yl)phenyl]ethanone
CID 22313830
2-(2,5-difluorophenyl)phenol
CID 53218546
2-(2,5-difluorophenyl)-4-methylphenol
CID 83129807
4-(2,4-dichlorophenyl)-1,3-thiazole
CID 4009904
4-fluoro-2-(5-propyl-1H-pyrazol-3-yl)phenol
CID 145330919
2-(3-amino-1,2-oxazol-5-yl)-4-fluorophenol
CID 137015317
4-[2-fluoro-3-(trifluoromethoxy)phenyl]-1,3-thiazole
CID 152598086
4-[2,5-bis(trifluoromethyl)phenyl]-1,3-thiazole
CID 91270161

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2-(1,3-thiazol-4-yl)phenol?
The IUPAC name of 4-fluoro-2-(1,3-thiazol-4-yl)phenol (CID 97033771) is 4-fluoro-2-(1,3-thiazol-4-yl)phenol.
What is the SMILES notation for 4-fluoro-2-(1,3-thiazol-4-yl)phenol?
The canonical SMILES for 4-fluoro-2-(1,3-thiazol-4-yl)phenol is Oc1ccc(F)cc1-c1cscn1.
What is the InChIKey of 4-fluoro-2-(1,3-thiazol-4-yl)phenol?
The InChIKey is FRNRLTSGOQVABL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6FNOS/c10-6-1-2-9(12)7(3-6)8-4-13-5-11-8/h1-5,12H.
What are the key properties of 4-fluoro-2-(1,3-thiazol-4-yl)phenol?
4-fluoro-2-(1,3-thiazol-4-yl)phenol has a molecular weight of 195.22 g/mol, XLogP of 2.65, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2-(1,3-thiazol-4-yl)phenol is sourced from PubChem (CID 97033771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).