(2-bromo-6-fluorophenyl)-thiophen-3-ylmethanol

C11H8BrFOS — CID 114885783

IUPAC(2-bromo-6-fluorophenyl)-thiophen-3-ylmethanol
SMILESOC(c1ccsc1)c1c(F)cccc1Br
InChIInChI=1S/C11H8BrFOS/c12-8-2-1-3-9(13)10(8)11(14)7-4-5-15-6-7/h1-6,11,14H
InChIKeyRPGFSKOFNNVAID-UHFFFAOYSA-N
MW287.15 g/mol
LogP3.73
Rot. Bonds2

About (2-bromo-6-fluorophenyl)-thiophen-3-ylmethanol

(2-bromo-6-fluorophenyl)-thiophen-3-ylmethanol (PubChem CID 114885783) has the molecular formula C11H8BrFOS and a molecular weight of 287.15 g/mol. Its IUPAC name is (2-bromo-6-fluorophenyl)-thiophen-3-ylmethanol.

Molecular Properties

Compound Name(2-bromo-6-fluorophenyl)-thiophen-3-ylmethanol
PubChem CID114885783
Molecular FormulaC11H8BrFOS
Molecular Weight287.15 g/mol
Exact Mass285.95
IUPAC Name(2-bromo-6-fluorophenyl)-thiophen-3-ylmethanol
SMILESOC(c1ccsc1)c1c(F)cccc1Br
InChIInChI=1S/C11H8BrFOS/c12-8-2-1-3-9(13)10(8)11(14)7-4-5-15-6-7/h1-6,11,14H
InChIKeyRPGFSKOFNNVAID-UHFFFAOYSA-N
XLogP3.73
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.15
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(R)-(2-bromo-6-fluorophenyl)-thiophen-3-ylmethanamine
CID 171203659
[(2-bromo-6-fluorophenyl)-thiophen-3-ylmethyl]hydrazine
CID 105280312
(2-bromo-6-fluorophenyl)-(4-bromothiophen-3-yl)methanol
CID 114885677
1-(2-bromo-6-fluorophenyl)-3-thiophen-3-ylpropan-1-ol
CID 114885636
(3-bromo-2-chlorophenyl)-thiophen-3-ylmethanol
CID 115805570
(2-bromo-6-fluorophenyl)-(furan-3-yl)methanol
CID 114885706
(2-bromo-6-fluorophenyl)-(4-methoxyphenyl)methanol
CID 114560429
(2-bromo-6-fluorophenyl)-naphthalen-2-ylmethanol
CID 114885765
(2-bromo-6-fluorophenyl)-(4-fluoro-3-methylphenyl)methanol
CID 114560510
(2-bromo-6-fluorophenyl)-(4-bromonaphthalen-1-yl)methanol
CID 114560508
1-(2-bromo-6-fluorophenyl)-2,2-difluoroethanol
CID 130062648
(4-bromophenyl)-(2,6-difluorophenyl)methanol
CID 61100872

Frequently Asked Questions

What is the IUPAC name of (2-bromo-6-fluorophenyl)-thiophen-3-ylmethanol?
The IUPAC name of (2-bromo-6-fluorophenyl)-thiophen-3-ylmethanol (CID 114885783) is (2-bromo-6-fluorophenyl)-thiophen-3-ylmethanol.
What is the SMILES notation for (2-bromo-6-fluorophenyl)-thiophen-3-ylmethanol?
The canonical SMILES for (2-bromo-6-fluorophenyl)-thiophen-3-ylmethanol is OC(c1ccsc1)c1c(F)cccc1Br.
What is the InChIKey of (2-bromo-6-fluorophenyl)-thiophen-3-ylmethanol?
The InChIKey is RPGFSKOFNNVAID-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8BrFOS/c12-8-2-1-3-9(13)10(8)11(14)7-4-5-15-6-7/h1-6,11,14H.
What are the key properties of (2-bromo-6-fluorophenyl)-thiophen-3-ylmethanol?
(2-bromo-6-fluorophenyl)-thiophen-3-ylmethanol has a molecular weight of 287.15 g/mol, XLogP of 3.73, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-bromo-6-fluorophenyl)-thiophen-3-ylmethanol is sourced from PubChem (CID 114885783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).