(5-chloro-2-fluorophenyl)-(3-chlorothiophen-2-yl)methanol

C11H7Cl2FOS — CID 80529355

IUPAC(5-chloro-2-fluorophenyl)-(3-chlorothiophen-2-yl)methanol
SMILESOC(c1cc(Cl)ccc1F)c1sccc1Cl
InChIInChI=1S/C11H7Cl2FOS/c12-6-1-2-9(14)7(5-6)10(15)11-8(13)3-4-16-11/h1-5,10,15H
InChIKeyQVQROUBGAJJRQH-UHFFFAOYSA-N
MW277.15 g/mol
LogP4.28
Rot. Bonds2

About (5-chloro-2-fluorophenyl)-(3-chlorothiophen-2-yl)methanol

(5-chloro-2-fluorophenyl)-(3-chlorothiophen-2-yl)methanol (PubChem CID 80529355) has the molecular formula C11H7Cl2FOS and a molecular weight of 277.15 g/mol. Its IUPAC name is (5-chloro-2-fluorophenyl)-(3-chlorothiophen-2-yl)methanol.

Molecular Properties

Compound Name(5-chloro-2-fluorophenyl)-(3-chlorothiophen-2-yl)methanol
PubChem CID80529355
Molecular FormulaC11H7Cl2FOS
Molecular Weight277.15 g/mol
Exact Mass275.96
IUPAC Name(5-chloro-2-fluorophenyl)-(3-chlorothiophen-2-yl)methanol
SMILESOC(c1cc(Cl)ccc1F)c1sccc1Cl
InChIInChI=1S/C11H7Cl2FOS/c12-6-1-2-9(14)7(5-6)10(15)11-8(13)3-4-16-11/h1-5,10,15H
InChIKeyQVQROUBGAJJRQH-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

(4-chloro-2-fluorophenyl)-(3-chlorothiophen-2-yl)methanol
CID 80530486
(3-chlorothiophen-2-yl)-(2,4-difluoro-5-methylphenyl)methanol
CID 80641878
(2-bromo-5-chlorophenyl)-(3-chlorothiophen-2-yl)methanol
CID 107359087
(3-bromothiophen-2-yl)-(5-chloro-2-fluorophenyl)methanol
CID 80535916
bis(3-chlorothiophen-2-yl)methanol
CID 80642135
(4-chloro-2,5-difluorophenyl)-(3-methylthiophen-2-yl)methanol
CID 82773068
(5-bromo-2-chlorophenyl)-(3-chlorothiophen-2-yl)methanol
CID 80530430
(3-bromo-5-chloro-2-methoxyphenyl)-(3-chlorothiophen-2-yl)methanol
CID 80642254
(3-chlorothiophen-2-yl)-(2,5-dimethylphenyl)methanol
CID 80530277
(5-chloro-2-fluorophenyl)-(4-chlorophenyl)methanol
CID 61100029
(4-bromothiophen-3-yl)-(3-chlorothiophen-2-yl)methanol
CID 115820110
3-chloro-2-[chloro-(2-fluoro-5-methylphenyl)methyl]thiophene
CID 80530635

Frequently Asked Questions

What is the IUPAC name of (5-chloro-2-fluorophenyl)-(3-chlorothiophen-2-yl)methanol?
The IUPAC name of (5-chloro-2-fluorophenyl)-(3-chlorothiophen-2-yl)methanol (CID 80529355) is (5-chloro-2-fluorophenyl)-(3-chlorothiophen-2-yl)methanol.
What is the SMILES notation for (5-chloro-2-fluorophenyl)-(3-chlorothiophen-2-yl)methanol?
The canonical SMILES for (5-chloro-2-fluorophenyl)-(3-chlorothiophen-2-yl)methanol is OC(c1cc(Cl)ccc1F)c1sccc1Cl.
What is the InChIKey of (5-chloro-2-fluorophenyl)-(3-chlorothiophen-2-yl)methanol?
The InChIKey is QVQROUBGAJJRQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7Cl2FOS/c12-6-1-2-9(14)7(5-6)10(15)11-8(13)3-4-16-11/h1-5,10,15H.
What are the key properties of (5-chloro-2-fluorophenyl)-(3-chlorothiophen-2-yl)methanol?
(5-chloro-2-fluorophenyl)-(3-chlorothiophen-2-yl)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 (5-chloro-2-fluorophenyl)-(3-chlorothiophen-2-yl)methanol is sourced from PubChem (CID 80529355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).