(5-bromofuran-2-yl)-(2,5-dibromophenyl)methanol

C11H7Br3O2 — CID 61099040

IUPAC(5-bromofuran-2-yl)-(2,5-dibromophenyl)methanol
SMILESOC(c1ccc(Br)o1)c1cc(Br)ccc1Br
InChIInChI=1S/C11H7Br3O2/c12-6-1-2-8(13)7(5-6)11(15)9-3-4-10(14)16-9/h1-5,11,15H
InChIKeyNKXSIWADDCDFLB-UHFFFAOYSA-N
MW410.89 g/mol
LogP4.65
Rot. Bonds2

About (5-bromofuran-2-yl)-(2,5-dibromophenyl)methanol

(5-bromofuran-2-yl)-(2,5-dibromophenyl)methanol (PubChem CID 61099040) has the molecular formula C11H7Br3O2 and a molecular weight of 410.89 g/mol. Its IUPAC name is (5-bromofuran-2-yl)-(2,5-dibromophenyl)methanol.

Molecular Properties

Compound Name(5-bromofuran-2-yl)-(2,5-dibromophenyl)methanol
PubChem CID61099040
Molecular FormulaC11H7Br3O2
Molecular Weight410.89 g/mol
Exact Mass407.80
IUPAC Name(5-bromofuran-2-yl)-(2,5-dibromophenyl)methanol
SMILESOC(c1ccc(Br)o1)c1cc(Br)ccc1Br
InChIInChI=1S/C11H7Br3O2/c12-6-1-2-8(13)7(5-6)11(15)9-3-4-10(14)16-9/h1-5,11,15H
InChIKeyNKXSIWADDCDFLB-UHFFFAOYSA-N
XLogP4.65
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.89
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2,5-dibromophenyl)-(5-methylfuran-2-yl)methanol
CID 61099394
(4-bromo-2,5-dimethoxyphenyl)-(5-bromofuran-2-yl)methanol
CID 105057068
(5-bromofuran-2-yl)-(2-chloro-4,5-difluorophenyl)methanol
CID 107477162
(5-bromofuran-2-yl)-(2-methylphenyl)methanol
CID 63895016
1-(5-bromofuran-2-yl)prop-2-yn-1-ol
CID 64914570
(2,5-dibromophenyl)-(2,6-dichlorophenyl)methanol
CID 63425825
(4-bromo-2-methoxyphenyl)-(2,5-dibromophenyl)methanol
CID 115369715
(2-bromo-4-chlorophenyl)-(2,5-dibromophenyl)methanol
CID 114024842
(4-bromo-2,5-dimethylphenyl)-(2,5-dibromophenyl)methanol
CID 114374820
2,2-dichloro-1-(2,5-dibromophenyl)ethanol
CID 163445311
(2,5-dibromophenyl)-(3,4-dichlorophenyl)methanol
CID 63426086
(2,5-dibromophenyl)-[4-(trifluoromethyl)phenyl]methanol
CID 63426128

Frequently Asked Questions

What is the IUPAC name of (5-bromofuran-2-yl)-(2,5-dibromophenyl)methanol?
The IUPAC name of (5-bromofuran-2-yl)-(2,5-dibromophenyl)methanol (CID 61099040) is (5-bromofuran-2-yl)-(2,5-dibromophenyl)methanol.
What is the SMILES notation for (5-bromofuran-2-yl)-(2,5-dibromophenyl)methanol?
The canonical SMILES for (5-bromofuran-2-yl)-(2,5-dibromophenyl)methanol is OC(c1ccc(Br)o1)c1cc(Br)ccc1Br.
What is the InChIKey of (5-bromofuran-2-yl)-(2,5-dibromophenyl)methanol?
The InChIKey is NKXSIWADDCDFLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7Br3O2/c12-6-1-2-8(13)7(5-6)11(15)9-3-4-10(14)16-9/h1-5,11,15H.
What are the key properties of (5-bromofuran-2-yl)-(2,5-dibromophenyl)methanol?
(5-bromofuran-2-yl)-(2,5-dibromophenyl)methanol has a molecular weight of 410.89 g/mol, XLogP of 4.65, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-bromofuran-2-yl)-(2,5-dibromophenyl)methanol is sourced from PubChem (CID 61099040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).