(3-bromofuran-2-yl)-(3,4-dichlorophenyl)methanol

C11H7BrCl2O2 — CID 63943199

IUPAC(3-bromofuran-2-yl)-(3,4-dichlorophenyl)methanol
SMILESOC(c1ccc(Cl)c(Cl)c1)c1occc1Br
InChIInChI=1S/C11H7BrCl2O2/c12-7-3-4-16-11(7)10(15)6-1-2-8(13)9(14)5-6/h1-5,10,15H
InChIKeyYUTRYMZJVJHRTK-UHFFFAOYSA-N
MW321.99 g/mol
LogP4.43
Rot. Bonds2

About (3-bromofuran-2-yl)-(3,4-dichlorophenyl)methanol

(3-bromofuran-2-yl)-(3,4-dichlorophenyl)methanol (PubChem CID 63943199) has the molecular formula C11H7BrCl2O2 and a molecular weight of 321.99 g/mol. Its IUPAC name is (3-bromofuran-2-yl)-(3,4-dichlorophenyl)methanol.

Molecular Properties

Compound Name(3-bromofuran-2-yl)-(3,4-dichlorophenyl)methanol
PubChem CID63943199
Molecular FormulaC11H7BrCl2O2
Molecular Weight321.99 g/mol
Exact Mass319.90
IUPAC Name(3-bromofuran-2-yl)-(3,4-dichlorophenyl)methanol
SMILESOC(c1ccc(Cl)c(Cl)c1)c1occc1Br
InChIInChI=1S/C11H7BrCl2O2/c12-7-3-4-16-11(7)10(15)6-1-2-8(13)9(14)5-6/h1-5,10,15H
InChIKeyYUTRYMZJVJHRTK-UHFFFAOYSA-N
XLogP4.43
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.99
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3-bromofuran-2-yl)-(3,4-difluorophenyl)methanol
CID 63942028
(3-bromofuran-2-yl)-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methanol
CID 63943588
(3-bromofuran-2-yl)-(4-fluoro-3-methylphenyl)methanol
CID 63944186
(3-bromofuran-2-yl)-(6-methyl-3-pyridinyl)methanol
CID 104823083
(3-bromo-4-chlorophenyl)-(furan-3-yl)methanol
CID 115566408
(3,5-dibromophenyl)-(3,4-dichlorophenyl)methanol
CID 107978749
(3-bromo-5-fluorophenyl)-(3-bromofuran-2-yl)methanol
CID 66423642
2-[chloro-(3,4-dichlorophenyl)methyl]-3-methylfuran
CID 63436451
(2,5-dibromophenyl)-(3,4-dichlorophenyl)methanol
CID 63426086
(3-bromofuran-2-yl)-(5-chloro-2-methylphenyl)methanol
CID 115800715
(3-bromofuran-2-yl)-[4-(trifluoromethoxy)phenyl]methanol
CID 63943204
(4-bromo-3-chlorophenyl)-(furan-2-yl)methanol
CID 115797505

Frequently Asked Questions

What is the IUPAC name of (3-bromofuran-2-yl)-(3,4-dichlorophenyl)methanol?
The IUPAC name of (3-bromofuran-2-yl)-(3,4-dichlorophenyl)methanol (CID 63943199) is (3-bromofuran-2-yl)-(3,4-dichlorophenyl)methanol.
What is the SMILES notation for (3-bromofuran-2-yl)-(3,4-dichlorophenyl)methanol?
The canonical SMILES for (3-bromofuran-2-yl)-(3,4-dichlorophenyl)methanol is OC(c1ccc(Cl)c(Cl)c1)c1occc1Br.
What is the InChIKey of (3-bromofuran-2-yl)-(3,4-dichlorophenyl)methanol?
The InChIKey is YUTRYMZJVJHRTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7BrCl2O2/c12-7-3-4-16-11(7)10(15)6-1-2-8(13)9(14)5-6/h1-5,10,15H.
What are the key properties of (3-bromofuran-2-yl)-(3,4-dichlorophenyl)methanol?
(3-bromofuran-2-yl)-(3,4-dichlorophenyl)methanol has a molecular weight of 321.99 g/mol, XLogP of 4.43, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-bromofuran-2-yl)-(3,4-dichlorophenyl)methanol is sourced from PubChem (CID 63943199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).