4-(3-chlorothiophen-2-yl)-2-fluorophenol

C10H6ClFOS — CID 107361324

IUPAC4-(3-chlorothiophen-2-yl)-2-fluorophenol
SMILESOc1ccc(-c2sccc2Cl)cc1F
InChIInChI=1S/C10H6ClFOS/c11-7-3-4-14-10(7)6-1-2-9(13)8(12)5-6/h1-5,13H
InChIKeySZIORDQFZRBTPQ-UHFFFAOYSA-N
MW228.68 g/mol
LogP3.91
Rot. Bonds1

About 4-(3-chlorothiophen-2-yl)-2-fluorophenol

4-(3-chlorothiophen-2-yl)-2-fluorophenol (PubChem CID 107361324) has the molecular formula C10H6ClFOS and a molecular weight of 228.68 g/mol. Its IUPAC name is 4-(3-chlorothiophen-2-yl)-2-fluorophenol.

Molecular Properties

Compound Name4-(3-chlorothiophen-2-yl)-2-fluorophenol
PubChem CID107361324
Molecular FormulaC10H6ClFOS
Molecular Weight228.68 g/mol
Exact Mass227.98
IUPAC Name4-(3-chlorothiophen-2-yl)-2-fluorophenol
SMILESOc1ccc(-c2sccc2Cl)cc1F
InChIInChI=1S/C10H6ClFOS/c11-7-3-4-14-10(7)6-1-2-9(13)8(12)5-6/h1-5,13H
InChIKeySZIORDQFZRBTPQ-UHFFFAOYSA-N
XLogP3.91
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.68
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(Thiophen-2-YL)phenol
CID 3564196
2-(Thiophen-2-yl)phenol
CID 3564195
4,4'-Thiene-2,5-Diylbis(3-Chlorophenol)
CID 71624342
2-fluoro-6-methyl-4-[(E)-2-thiophen-2-ylethenyl]phenol
CID 14771894
4-[(E)-2-(5-chlorothiophen-2-yl)ethenyl]-2,6-dimethylphenol
CID 14771922
3-Chloro-4-[4-(2-chloro-4-hydroxyphenyl)thiophen-2-yl]phenol
CID 71624679
4-(5-Chlorothiophen-2-yl)benzene-1,2-diol
CID 25130841
4-(Thiophen-3-yl)phenol
CID 4130342
4-[(Thiophen-2-yl)methyl]phenol
CID 605440
4,4'-(Thiene-2,3-Diyl)bis(3-Fluorophenol)
CID 71624682
4-(3-Chlorothiophen-2-yl)benzene-1,2-diol
CID 53361308
3-Fluoro-4-[4-(2-fluoro-4-hydroxyphenyl)thiophen-2-yl]phenol
CID 71624678

Frequently Asked Questions

What is the IUPAC name of 4-(3-chlorothiophen-2-yl)-2-fluorophenol?
The IUPAC name of 4-(3-chlorothiophen-2-yl)-2-fluorophenol (CID 107361324) is 4-(3-chlorothiophen-2-yl)-2-fluorophenol.
What is the SMILES notation for 4-(3-chlorothiophen-2-yl)-2-fluorophenol?
The canonical SMILES for 4-(3-chlorothiophen-2-yl)-2-fluorophenol is Oc1ccc(-c2sccc2Cl)cc1F.
What is the InChIKey of 4-(3-chlorothiophen-2-yl)-2-fluorophenol?
The InChIKey is SZIORDQFZRBTPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6ClFOS/c11-7-3-4-14-10(7)6-1-2-9(13)8(12)5-6/h1-5,13H.
What are the key properties of 4-(3-chlorothiophen-2-yl)-2-fluorophenol?
4-(3-chlorothiophen-2-yl)-2-fluorophenol has a molecular weight of 228.68 g/mol, XLogP of 3.91, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-chlorothiophen-2-yl)-2-fluorophenol is sourced from PubChem (CID 107361324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).