[2-(5-bromofuran-2-yl)cyclopropyl]methanol

C8H9BrO2 — CID 81358732

IUPAC[2-(5-bromofuran-2-yl)cyclopropyl]methanol
SMILESOCC1CC1c1ccc(Br)o1
InChIInChI=1S/C8H9BrO2/c9-8-2-1-7(11-8)6-3-5(6)4-10/h1-2,5-6,10H,3-4H2
InChIKeyWHTDMNNQIZEXIV-UHFFFAOYSA-N
MW217.06 g/mol
LogP2.14
Rot. Bonds2

About [2-(5-bromofuran-2-yl)cyclopropyl]methanol

[2-(5-bromofuran-2-yl)cyclopropyl]methanol (PubChem CID 81358732) has the molecular formula C8H9BrO2 and a molecular weight of 217.06 g/mol. Its IUPAC name is [2-(5-bromofuran-2-yl)cyclopropyl]methanol.

Molecular Properties

Compound Name[2-(5-bromofuran-2-yl)cyclopropyl]methanol
PubChem CID81358732
Molecular FormulaC8H9BrO2
Molecular Weight217.06 g/mol
Exact Mass215.98
IUPAC Name[2-(5-bromofuran-2-yl)cyclopropyl]methanol
SMILESOCC1CC1c1ccc(Br)o1
InChIInChI=1S/C8H9BrO2/c9-8-2-1-7(11-8)6-3-5(6)4-10/h1-2,5-6,10H,3-4H2
InChIKeyWHTDMNNQIZEXIV-UHFFFAOYSA-N
XLogP2.14
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.06
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [2-(5-bromofuran-2-yl)cyclopropyl]methanol?
The IUPAC name of [2-(5-bromofuran-2-yl)cyclopropyl]methanol (CID 81358732) is [2-(5-bromofuran-2-yl)cyclopropyl]methanol.
What is the SMILES notation for [2-(5-bromofuran-2-yl)cyclopropyl]methanol?
The canonical SMILES for [2-(5-bromofuran-2-yl)cyclopropyl]methanol is OCC1CC1c1ccc(Br)o1.
What is the InChIKey of [2-(5-bromofuran-2-yl)cyclopropyl]methanol?
The InChIKey is WHTDMNNQIZEXIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9BrO2/c9-8-2-1-7(11-8)6-3-5(6)4-10/h1-2,5-6,10H,3-4H2.
What are the key properties of [2-(5-bromofuran-2-yl)cyclopropyl]methanol?
[2-(5-bromofuran-2-yl)cyclopropyl]methanol has a molecular weight of 217.06 g/mol, XLogP of 2.14, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(5-bromofuran-2-yl)cyclopropyl]methanol is sourced from PubChem (CID 81358732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).