actinium;6-methyl-1-benzofuran-3-ol

C9H8AcO2 — CID 59083990

IUPACactinium;6-methyl-1-benzofuran-3-ol
SMILESCc1ccc2c(O)coc2c1.[Ac]
InChIInChI=1S/C9H8O2.Ac/c1-6-2-3-7-8(10)5-11-9(7)4-6;/h2-5,10H,1H3;
InChIKeyQHZQEELIHZITDR-UHFFFAOYSA-N
MW375.16 g/mol
LogP2.45
Rot. Bonds

About actinium;6-methyl-1-benzofuran-3-ol

actinium;6-methyl-1-benzofuran-3-ol (PubChem CID 59083990) has the molecular formula C9H8AcO2 and a molecular weight of 375.16 g/mol. Its IUPAC name is actinium;6-methyl-1-benzofuran-3-ol.

Molecular Properties

Compound Nameactinium;6-methyl-1-benzofuran-3-ol
PubChem CID59083990
Molecular FormulaC9H8AcO2
Molecular Weight375.16 g/mol
Exact Mass375.08
IUPAC Nameactinium;6-methyl-1-benzofuran-3-ol
SMILESCc1ccc2c(O)coc2c1.[Ac]
InChIInChI=1S/C9H8O2.Ac/c1-6-2-3-7-8(10)5-11-9(7)4-6;/h2-5,10H,1H3;
InChIKeyQHZQEELIHZITDR-UHFFFAOYSA-N
XLogP2.45
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.16
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(6-methyl-1-benzofuran-3-yl)methanol
CID 11084186
6-iodo-1-benzofuran-3-ol
CID 123196484
4-methyl-2-(5-methyl-1-benzofuran-3-yl)phenol
CID 22753091
N,N-bis(1-benzofuran-3-yl)-6-methyl-1-benzofuran-3-amine
CID 155630972
6-prop-1-enoxy-1-benzofuran-3-ol
CID 54059600
1-benzofuran-3-ol;methane
CID 175138306
benzo[f][1]benzofuran-3-ol
CID 54429171
6-methyl-3-(methylsulfonylmethyl)-1-benzofuran
CID 117185515
1-(6-methyl-1-benzofuran-3-yl)piperidine
CID 139266924
6-methyl-3-(propan-2-ylsulfanylmethyl)-1-benzofuran
CID 117185548
3-(4-fluorobenzoyl)-7-methylchromen-4-one
CID 775952
3,6-dimethylbenzo[f][1]benzofuran
CID 13333920

Frequently Asked Questions

What is the IUPAC name of actinium;6-methyl-1-benzofuran-3-ol?
The IUPAC name of actinium;6-methyl-1-benzofuran-3-ol (CID 59083990) is actinium;6-methyl-1-benzofuran-3-ol.
What is the SMILES notation for actinium;6-methyl-1-benzofuran-3-ol?
The canonical SMILES for actinium;6-methyl-1-benzofuran-3-ol is Cc1ccc2c(O)coc2c1.[Ac].
What is the InChIKey of actinium;6-methyl-1-benzofuran-3-ol?
The InChIKey is QHZQEELIHZITDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8O2.Ac/c1-6-2-3-7-8(10)5-11-9(7)4-6;/h2-5,10H,1H3;.
What are the key properties of actinium;6-methyl-1-benzofuran-3-ol?
actinium;6-methyl-1-benzofuran-3-ol has a molecular weight of 375.16 g/mol, XLogP of 2.45, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for actinium;6-methyl-1-benzofuran-3-ol is sourced from PubChem (CID 59083990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).