[5-(2,4,6-tribromophenyl)furan-2-yl]methanol

C11H7Br3O2 — CID 60895636

IUPAC[5-(2,4,6-tribromophenyl)furan-2-yl]methanol
SMILESOCc1ccc(-c2c(Br)cc(Br)cc2Br)o1
InChIInChI=1S/C11H7Br3O2/c12-6-3-8(13)11(9(14)4-6)10-2-1-7(5-15)16-10/h1-4,15H,5H2
InChIKeyDSCYYDMSBDVEFF-UHFFFAOYSA-N
MW410.89 g/mol
LogP4.73
Rot. Bonds2

About [5-(2,4,6-tribromophenyl)furan-2-yl]methanol

[5-(2,4,6-tribromophenyl)furan-2-yl]methanol (PubChem CID 60895636) has the molecular formula C11H7Br3O2 and a molecular weight of 410.89 g/mol. Its IUPAC name is [5-(2,4,6-tribromophenyl)furan-2-yl]methanol.

Molecular Properties

Compound Name[5-(2,4,6-tribromophenyl)furan-2-yl]methanol
PubChem CID60895636
Molecular FormulaC11H7Br3O2
Molecular Weight410.89 g/mol
Exact Mass407.80
IUPAC Name[5-(2,4,6-tribromophenyl)furan-2-yl]methanol
SMILESOCc1ccc(-c2c(Br)cc(Br)cc2Br)o1
InChIInChI=1S/C11H7Br3O2/c12-6-3-8(13)11(9(14)4-6)10-2-1-7(5-15)16-10/h1-4,15H,5H2
InChIKeyDSCYYDMSBDVEFF-UHFFFAOYSA-N
XLogP4.73
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 ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[5-(2,4,6-tribromophenyl)furan-2-yl]methanamine
CID 43155894
1-[5-(2,4,6-tribromophenyl)furan-2-yl]propan-2-ol
CID 55180164
[5-(2,3,4,5,6-pentafluorophenyl)furan-2-yl]methanol
CID 115564832
[5-(4-bromo-2-fluorophenyl)furan-2-yl]methanol
CID 28693697
[5-(4-bromo-3-methoxyphenyl)furan-2-yl]methanol
CID 107622909
[5-(5-bromothiophen-2-yl)furan-2-yl]methanol
CID 71530015
[5-[(2,4-dibromoanilino)methyl]furan-2-yl]methanol
CID 64579776
[5-[4-bromo-2,6-bis(trifluoromethyl)phenyl]furan-2-yl]methanamine
CID 126602269
[4-[5-(hydroxymethyl)furan-2-yl]phenyl]methanol
CID 163843794
3,5-dibromo-N-[5-[5-(hydroxymethyl)furan-2-yl]-2-methoxyphenyl]-2-iodobenzamide
CID 43866247
N-[[5-(2,6-dibromo-4-methylphenyl)furan-2-yl]methyl]propan-1-amine
CID 43624854
[5-(3-amino-4-methylphenyl)furan-2-yl]methanol
CID 2987173

Frequently Asked Questions

What is the IUPAC name of [5-(2,4,6-tribromophenyl)furan-2-yl]methanol?
The IUPAC name of [5-(2,4,6-tribromophenyl)furan-2-yl]methanol (CID 60895636) is [5-(2,4,6-tribromophenyl)furan-2-yl]methanol.
What is the SMILES notation for [5-(2,4,6-tribromophenyl)furan-2-yl]methanol?
The canonical SMILES for [5-(2,4,6-tribromophenyl)furan-2-yl]methanol is OCc1ccc(-c2c(Br)cc(Br)cc2Br)o1.
What is the InChIKey of [5-(2,4,6-tribromophenyl)furan-2-yl]methanol?
The InChIKey is DSCYYDMSBDVEFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7Br3O2/c12-6-3-8(13)11(9(14)4-6)10-2-1-7(5-15)16-10/h1-4,15H,5H2.
What are the key properties of [5-(2,4,6-tribromophenyl)furan-2-yl]methanol?
[5-(2,4,6-tribromophenyl)furan-2-yl]methanol has a molecular weight of 410.89 g/mol, XLogP of 4.73, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(2,4,6-tribromophenyl)furan-2-yl]methanol is sourced from PubChem (CID 60895636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).