7-bromo-2,3-dihydro-1-benzofuran-5-ol

C8H7BrO2 — CID 84680724

IUPAC7-bromo-2,3-dihydro-1-benzofuran-5-ol
SMILESOc1cc(Br)c2c(c1)CCO2
InChIInChI=1S/C8H7BrO2/c9-7-4-6(10)3-5-1-2-11-8(5)7/h3-4,10H,1-2H2
InChIKeyNRAVGOYGGNRSCU-UHFFFAOYSA-N
MW215.05 g/mol
LogP2.09
Rot. Bonds

About 7-bromo-2,3-dihydro-1-benzofuran-5-ol

7-bromo-2,3-dihydro-1-benzofuran-5-ol (PubChem CID 84680724) has the molecular formula C8H7BrO2 and a molecular weight of 215.05 g/mol. Its IUPAC name is 7-bromo-2,3-dihydro-1-benzofuran-5-ol.

Molecular Properties

Compound Name7-bromo-2,3-dihydro-1-benzofuran-5-ol
PubChem CID84680724
Molecular FormulaC8H7BrO2
Molecular Weight215.05 g/mol
Exact Mass213.96
IUPAC Name7-bromo-2,3-dihydro-1-benzofuran-5-ol
SMILESOc1cc(Br)c2c(c1)CCO2
InChIInChI=1S/C8H7BrO2/c9-7-4-6(10)3-5-1-2-11-8(5)7/h3-4,10H,1-2H2
InChIKeyNRAVGOYGGNRSCU-UHFFFAOYSA-N
XLogP2.09
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.05
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-bromo-2,3-dihydro-1-benzofuran-5-ol?
The IUPAC name of 7-bromo-2,3-dihydro-1-benzofuran-5-ol (CID 84680724) is 7-bromo-2,3-dihydro-1-benzofuran-5-ol.
What is the SMILES notation for 7-bromo-2,3-dihydro-1-benzofuran-5-ol?
The canonical SMILES for 7-bromo-2,3-dihydro-1-benzofuran-5-ol is Oc1cc(Br)c2c(c1)CCO2.
What is the InChIKey of 7-bromo-2,3-dihydro-1-benzofuran-5-ol?
The InChIKey is NRAVGOYGGNRSCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7BrO2/c9-7-4-6(10)3-5-1-2-11-8(5)7/h3-4,10H,1-2H2.
What are the key properties of 7-bromo-2,3-dihydro-1-benzofuran-5-ol?
7-bromo-2,3-dihydro-1-benzofuran-5-ol has a molecular weight of 215.05 g/mol, XLogP of 2.09, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-2,3-dihydro-1-benzofuran-5-ol is sourced from PubChem (CID 84680724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).