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

C12H10Br2O2 — CID 61099394

IUPAC(2,5-dibromophenyl)-(5-methylfuran-2-yl)methanol
SMILESCc1ccc(C(O)c2cc(Br)ccc2Br)o1
InChIInChI=1S/C12H10Br2O2/c1-7-2-5-11(16-7)12(15)9-6-8(13)3-4-10(9)14/h2-6,12,15H,1H3
InChIKeyBDKSOBJUWLHIAV-UHFFFAOYSA-N
MW346.02 g/mol
LogP4.19
Rot. Bonds2

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

(2,5-dibromophenyl)-(5-methylfuran-2-yl)methanol (PubChem CID 61099394) has the molecular formula C12H10Br2O2 and a molecular weight of 346.02 g/mol. Its IUPAC name is (2,5-dibromophenyl)-(5-methylfuran-2-yl)methanol.

Molecular Properties

Compound Name(2,5-dibromophenyl)-(5-methylfuran-2-yl)methanol
PubChem CID61099394
Molecular FormulaC12H10Br2O2
Molecular Weight346.02 g/mol
Exact Mass343.90
IUPAC Name(2,5-dibromophenyl)-(5-methylfuran-2-yl)methanol
SMILESCc1ccc(C(O)c2cc(Br)ccc2Br)o1
InChIInChI=1S/C12H10Br2O2/c1-7-2-5-11(16-7)12(15)9-6-8(13)3-4-10(9)14/h2-6,12,15H,1H3
InChIKeyBDKSOBJUWLHIAV-UHFFFAOYSA-N
XLogP4.19
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.02
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(5-bromofuran-2-yl)-(2,5-dibromophenyl)methanol
CID 61099040
(2,5-dibromo-4-methylphenyl)-(5-methylfuran-2-yl)methanol
CID 81473148
(4-bromo-2,5-dimethylphenyl)-(2,5-dibromophenyl)methanol
CID 114374820
(4-bromo-2-methoxyphenyl)-(2,5-dibromophenyl)methanol
CID 115369715
(5-bromo-2-fluorophenyl)-(2-bromo-5-methylphenyl)methanol
CID 115820779
(3-chloro-5-methylphenyl)-(2,5-dibromophenyl)methanol
CID 81324953
2-[(5-bromo-2-methoxyphenyl)-chloromethyl]-5-methylfuran
CID 61082150
(2,5-dibromophenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol
CID 102759051
(2,5-dibromophenyl)-(2,4,5-trimethylfuran-3-yl)methanamine
CID 65151889
(2,3-dimethylphenyl)-(5-methylfuran-2-yl)methanol
CID 63894230
(2-chlorophenyl)-(5-methylfuran-2-yl)methanol
CID 23912548
(2-bromo-4-chlorophenyl)-(2,5-dibromophenyl)methanol
CID 114024842

Frequently Asked Questions

What is the IUPAC name of (2,5-dibromophenyl)-(5-methylfuran-2-yl)methanol?
The IUPAC name of (2,5-dibromophenyl)-(5-methylfuran-2-yl)methanol (CID 61099394) is (2,5-dibromophenyl)-(5-methylfuran-2-yl)methanol.
What is the SMILES notation for (2,5-dibromophenyl)-(5-methylfuran-2-yl)methanol?
The canonical SMILES for (2,5-dibromophenyl)-(5-methylfuran-2-yl)methanol is Cc1ccc(C(O)c2cc(Br)ccc2Br)o1.
What is the InChIKey of (2,5-dibromophenyl)-(5-methylfuran-2-yl)methanol?
The InChIKey is BDKSOBJUWLHIAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10Br2O2/c1-7-2-5-11(16-7)12(15)9-6-8(13)3-4-10(9)14/h2-6,12,15H,1H3.
What are the key properties of (2,5-dibromophenyl)-(5-methylfuran-2-yl)methanol?
(2,5-dibromophenyl)-(5-methylfuran-2-yl)methanol has a molecular weight of 346.02 g/mol, XLogP of 4.19, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dibromophenyl)-(5-methylfuran-2-yl)methanol is sourced from PubChem (CID 61099394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).