(2,5-dichlorothiophen-3-yl)-(2-fluorophenyl)methanol

C11H7Cl2FOS — CID 61082413

IUPAC(2,5-dichlorothiophen-3-yl)-(2-fluorophenyl)methanol
SMILESOC(c1ccccc1F)c1cc(Cl)sc1Cl
InChIInChI=1S/C11H7Cl2FOS/c12-9-5-7(11(13)16-9)10(15)6-3-1-2-4-8(6)14/h1-5,10,15H
InChIKeyGYMMCRMKNXWPBT-UHFFFAOYSA-N
MW277.15 g/mol
LogP4.28
Rot. Bonds2

About (2,5-dichlorothiophen-3-yl)-(2-fluorophenyl)methanol

(2,5-dichlorothiophen-3-yl)-(2-fluorophenyl)methanol (PubChem CID 61082413) has the molecular formula C11H7Cl2FOS and a molecular weight of 277.15 g/mol. Its IUPAC name is (2,5-dichlorothiophen-3-yl)-(2-fluorophenyl)methanol.

Molecular Properties

Compound Name(2,5-dichlorothiophen-3-yl)-(2-fluorophenyl)methanol
PubChem CID61082413
Molecular FormulaC11H7Cl2FOS
Molecular Weight277.15 g/mol
Exact Mass275.96
IUPAC Name(2,5-dichlorothiophen-3-yl)-(2-fluorophenyl)methanol
SMILESOC(c1ccccc1F)c1cc(Cl)sc1Cl
InChIInChI=1S/C11H7Cl2FOS/c12-9-5-7(11(13)16-9)10(15)6-3-1-2-4-8(6)14/h1-5,10,15H
InChIKeyGYMMCRMKNXWPBT-UHFFFAOYSA-N
XLogP4.28
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.15
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,5-dichloro-3-[chloro-(2-fluorophenyl)methyl]thiophene
CID 63436567
(2,5-dichlorothiophen-3-yl)-(2,5-difluoro-4-methylphenyl)methanol
CID 107964322
(4-bromo-2-fluorophenyl)-(2,5-dichlorothiophen-3-yl)methanol
CID 61082809
bis(2-fluorophenyl)methanol
CID 18424663
(2,5-dichlorothiophen-3-yl)-phenylmethanol
CID 61082614
2-[(2,5-dichlorothiophen-3-yl)-hydroxymethyl]benzoic acid
CID 43167368
(4-bromo-2,5-difluorophenyl)-(2,5-dichlorothiophen-3-yl)methanol
CID 107964287
(2,4-dichlorophenyl)-(2,5-dichlorothiophen-3-yl)methanol
CID 63426938
(2-chloro-4-fluoro-5-methylphenyl)-(2-fluorophenyl)methanol
CID 81045704
4-chloro-2-[(2-fluorophenyl)-hydroxymethyl]phenol
CID 21400433
(2-chloro-4-methylphenyl)-(2,5-dichlorothiophen-3-yl)methanol
CID 106862706
2-(2-chloro-6-fluorophenyl)-1-(2,5-dichlorothiophen-3-yl)ethanol
CID 61083005

Frequently Asked Questions

What is the IUPAC name of (2,5-dichlorothiophen-3-yl)-(2-fluorophenyl)methanol?
The IUPAC name of (2,5-dichlorothiophen-3-yl)-(2-fluorophenyl)methanol (CID 61082413) is (2,5-dichlorothiophen-3-yl)-(2-fluorophenyl)methanol.
What is the SMILES notation for (2,5-dichlorothiophen-3-yl)-(2-fluorophenyl)methanol?
The canonical SMILES for (2,5-dichlorothiophen-3-yl)-(2-fluorophenyl)methanol is OC(c1ccccc1F)c1cc(Cl)sc1Cl.
What is the InChIKey of (2,5-dichlorothiophen-3-yl)-(2-fluorophenyl)methanol?
The InChIKey is GYMMCRMKNXWPBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7Cl2FOS/c12-9-5-7(11(13)16-9)10(15)6-3-1-2-4-8(6)14/h1-5,10,15H.
What are the key properties of (2,5-dichlorothiophen-3-yl)-(2-fluorophenyl)methanol?
(2,5-dichlorothiophen-3-yl)-(2-fluorophenyl)methanol has a molecular weight of 277.15 g/mol, XLogP of 4.28, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dichlorothiophen-3-yl)-(2-fluorophenyl)methanol is sourced from PubChem (CID 61082413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).