2,2-dimethyl-3H-1-benzofuran-7-ol

C10H12O2 — CID 15278

IUPAC2,2-dimethyl-3H-1-benzofuran-7-ol
SMILESCC1(C)Cc2cccc(O)c2O1
InChIInChI=1S/C10H12O2/c1-10(2)6-7-4-3-5-8(11)9(7)12-10/h3-5,11H,6H2,1-2H3
InChIKeyWJGPNUBJBMCRQH-UHFFFAOYSA-N
MW164.20 g/mol
LogP2.11
Rot. Bonds

About 2,2-dimethyl-3H-1-benzofuran-7-ol

2,2-dimethyl-3H-1-benzofuran-7-ol (PubChem CID 15278) has the molecular formula C10H12O2 and a molecular weight of 164.20 g/mol. Its IUPAC name is 2,2-dimethyl-3H-1-benzofuran-7-ol.

Molecular Properties

Compound Name2,2-dimethyl-3H-1-benzofuran-7-ol
PubChem CID15278
Molecular FormulaC10H12O2
Molecular Weight164.20 g/mol
Exact Mass164.08
IUPAC Name2,2-dimethyl-3H-1-benzofuran-7-ol
SMILESCC1(C)Cc2cccc(O)c2O1
InChIInChI=1S/C10H12O2/c1-10(2)6-7-4-3-5-8(11)9(7)12-10/h3-5,11H,6H2,1-2H3
InChIKeyWJGPNUBJBMCRQH-UHFFFAOYSA-N
XLogP2.11
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.20
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-3H-1-benzofuran-7-ol?
The IUPAC name of 2,2-dimethyl-3H-1-benzofuran-7-ol (CID 15278) is 2,2-dimethyl-3H-1-benzofuran-7-ol.
What is the SMILES notation for 2,2-dimethyl-3H-1-benzofuran-7-ol?
The canonical SMILES for 2,2-dimethyl-3H-1-benzofuran-7-ol is CC1(C)Cc2cccc(O)c2O1.
What is the InChIKey of 2,2-dimethyl-3H-1-benzofuran-7-ol?
The InChIKey is WJGPNUBJBMCRQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12O2/c1-10(2)6-7-4-3-5-8(11)9(7)12-10/h3-5,11H,6H2,1-2H3.
What are the key properties of 2,2-dimethyl-3H-1-benzofuran-7-ol?
2,2-dimethyl-3H-1-benzofuran-7-ol has a molecular weight of 164.20 g/mol, XLogP of 2.11, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-3H-1-benzofuran-7-ol is sourced from PubChem (CID 15278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).