(2-fluoro-4-methoxyphenyl)-thiophen-3-ylmethanol

C12H11FO2S — CID 61082292

IUPAC(2-fluoro-4-methoxyphenyl)-thiophen-3-ylmethanol
SMILESCOc1ccc(C(O)c2ccsc2)c(F)c1
InChIInChI=1S/C12H11FO2S/c1-15-9-2-3-10(11(13)6-9)12(14)8-4-5-16-7-8/h2-7,12,14H,1H3
InChIKeyZRXMWQFTACYNJX-UHFFFAOYSA-N
MW238.28 g/mol
LogP2.98
Rot. Bonds3

About (2-fluoro-4-methoxyphenyl)-thiophen-3-ylmethanol

(2-fluoro-4-methoxyphenyl)-thiophen-3-ylmethanol (PubChem CID 61082292) has the molecular formula C12H11FO2S and a molecular weight of 238.28 g/mol. Its IUPAC name is (2-fluoro-4-methoxyphenyl)-thiophen-3-ylmethanol.

Molecular Properties

Compound Name(2-fluoro-4-methoxyphenyl)-thiophen-3-ylmethanol
PubChem CID61082292
Molecular FormulaC12H11FO2S
Molecular Weight238.28 g/mol
Exact Mass238.05
IUPAC Name(2-fluoro-4-methoxyphenyl)-thiophen-3-ylmethanol
SMILESCOc1ccc(C(O)c2ccsc2)c(F)c1
InChIInChI=1S/C12H11FO2S/c1-15-9-2-3-10(11(13)6-9)12(14)8-4-5-16-7-8/h2-7,12,14H,1H3
InChIKeyZRXMWQFTACYNJX-UHFFFAOYSA-N
XLogP2.98
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.28
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

bis(2-fluoro-4-methoxyphenyl)methanol
CID 102884350
(3,5-difluorophenyl)-(2-fluoro-4-methoxyphenyl)methanol
CID 61083265
(2-fluoro-4-methoxyphenyl)-pyridazin-4-ylmethanol
CID 103397496
(4-methoxythiophen-2-yl)-thiophen-3-ylmethanol
CID 115805532
(3-bromo-4-chlorophenyl)-(2-fluoro-4-methoxyphenyl)methanol
CID 103395113
(2,5-difluorophenyl)-thiophen-3-ylmethanol
CID 61099759
(R)-(2-methoxyphenyl)-thiophen-3-ylmethanol
CID 93312294
(2-fluoro-4-methoxyphenyl)-(2,3,5,6-tetramethylphenyl)methanol
CID 102884337
(2,4-dimethylphenyl)-(2-fluoro-4-methoxyphenyl)methanol
CID 61080731
3-[bromo-(2-chloro-4-methoxyphenyl)methyl]thiophene
CID 61098604
(2-chloro-4,5-dimethoxyphenyl)-thiophen-3-ylmethanol
CID 61081785
(5-bromo-4-methylthiophen-2-yl)-(2-fluoro-4-methoxyphenyl)methanol
CID 79996742

Frequently Asked Questions

What is the IUPAC name of (2-fluoro-4-methoxyphenyl)-thiophen-3-ylmethanol?
The IUPAC name of (2-fluoro-4-methoxyphenyl)-thiophen-3-ylmethanol (CID 61082292) is (2-fluoro-4-methoxyphenyl)-thiophen-3-ylmethanol.
What is the SMILES notation for (2-fluoro-4-methoxyphenyl)-thiophen-3-ylmethanol?
The canonical SMILES for (2-fluoro-4-methoxyphenyl)-thiophen-3-ylmethanol is COc1ccc(C(O)c2ccsc2)c(F)c1.
What is the InChIKey of (2-fluoro-4-methoxyphenyl)-thiophen-3-ylmethanol?
The InChIKey is ZRXMWQFTACYNJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11FO2S/c1-15-9-2-3-10(11(13)6-9)12(14)8-4-5-16-7-8/h2-7,12,14H,1H3.
What are the key properties of (2-fluoro-4-methoxyphenyl)-thiophen-3-ylmethanol?
(2-fluoro-4-methoxyphenyl)-thiophen-3-ylmethanol has a molecular weight of 238.28 g/mol, XLogP of 2.98, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluoro-4-methoxyphenyl)-thiophen-3-ylmethanol is sourced from PubChem (CID 61082292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).