1-benzofuran-2-yl-dimethyl-[2-(oxan-2-yloxymethyl)phenyl]silane

C22H26O3Si — CID 122374661

IUPAC1-benzofuran-2-yl-dimethyl-[2-(oxan-2-yloxymethyl)phenyl]silane
SMILESC[Si](C)(c1cc2ccccc2o1)c1ccccc1COC1CCCCO1
InChIInChI=1S/C22H26O3Si/c1-26(2,22-15-17-9-3-5-11-19(17)25-22)20-12-6-4-10-18(20)16-24-21-13-7-8-14-23-21/h3-6,9-12,15,21H,7-8,13-14,16H2,1-2H3
InChIKeyGYXCHQXKECZEHD-UHFFFAOYSA-N
MW366.53 g/mol
LogP4.30
Rot. Bonds5

About 1-benzofuran-2-yl-dimethyl-[2-(oxan-2-yloxymethyl)phenyl]silane

1-benzofuran-2-yl-dimethyl-[2-(oxan-2-yloxymethyl)phenyl]silane (PubChem CID 122374661) has the molecular formula C22H26O3Si and a molecular weight of 366.53 g/mol. Its IUPAC name is 1-benzofuran-2-yl-dimethyl-[2-(oxan-2-yloxymethyl)phenyl]silane.

Molecular Properties

Compound Name1-benzofuran-2-yl-dimethyl-[2-(oxan-2-yloxymethyl)phenyl]silane
PubChem CID122374661
Molecular FormulaC22H26O3Si
Molecular Weight366.53 g/mol
Exact Mass366.17
IUPAC Name1-benzofuran-2-yl-dimethyl-[2-(oxan-2-yloxymethyl)phenyl]silane
SMILESC[Si](C)(c1cc2ccccc2o1)c1ccccc1COC1CCCCO1
InChIInChI=1S/C22H26O3Si/c1-26(2,22-15-17-9-3-5-11-19(17)25-22)20-12-6-4-10-18(20)16-24-21-13-7-8-14-23-21/h3-6,9-12,15,21H,7-8,13-14,16H2,1-2H3
InChIKeyGYXCHQXKECZEHD-UHFFFAOYSA-N
XLogP4.30
TPSA31.60 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.53
LogP ≤ 54.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

(3,5-dimethylphenyl)-dimethyl-[2-(oxan-2-yloxymethyl)phenyl]silane
CID 102529916
2-(naphthalen-1-ylmethoxy)oxane
CID 15471078
2-[[2-[[2-[[2-(oxan-2-yloxymethyl)phenyl]methyl]phenyl]methyl]phenyl]methoxy]oxane
CID 10458131
2-[(2-methylsulfanylphenyl)methoxy]oxane
CID 156806048
dimethyl-[2-(oxan-2-yloxymethyl)phenyl]silane
CID 102158600
4-methyl-2-(oxan-2-yloxymethyl)benzenethiol
CID 19776911
(3-bromo-5,5-dipentylbenzo[b][1]benzosilol-7-yl)-dimethyl-[2-(oxan-2-yloxymethyl)phenyl]silane
CID 23643149
2-[[3-[[2-[[2-[(2-benzylphenyl)methyl]phenyl]methyl]phenyl]methyl]phenyl]methoxy]oxane
CID 10392867
2-(oxan-2-yloxymethyl)pyrimidine
CID 154401140
2-[(2,3-dimethoxyphenyl)methoxy]oxane
CID 11265241
[4-(oxan-2-yloxymethyl)phenyl]-diphenylphosphane
CID 71336769
2-[3-(oxan-2-yloxymethyl)quinolin-2-yl]prop-2-enoic acid
CID 15338659

Frequently Asked Questions

What is the IUPAC name of 1-benzofuran-2-yl-dimethyl-[2-(oxan-2-yloxymethyl)phenyl]silane?
The IUPAC name of 1-benzofuran-2-yl-dimethyl-[2-(oxan-2-yloxymethyl)phenyl]silane (CID 122374661) is 1-benzofuran-2-yl-dimethyl-[2-(oxan-2-yloxymethyl)phenyl]silane.
What is the SMILES notation for 1-benzofuran-2-yl-dimethyl-[2-(oxan-2-yloxymethyl)phenyl]silane?
The canonical SMILES for 1-benzofuran-2-yl-dimethyl-[2-(oxan-2-yloxymethyl)phenyl]silane is C[Si](C)(c1cc2ccccc2o1)c1ccccc1COC1CCCCO1.
What is the InChIKey of 1-benzofuran-2-yl-dimethyl-[2-(oxan-2-yloxymethyl)phenyl]silane?
The InChIKey is GYXCHQXKECZEHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26O3Si/c1-26(2,22-15-17-9-3-5-11-19(17)25-22)20-12-6-4-10-18(20)16-24-21-13-7-8-14-23-21/h3-6,9-12,15,21H,7-8,13-14,16H2,1-2H3.
What are the key properties of 1-benzofuran-2-yl-dimethyl-[2-(oxan-2-yloxymethyl)phenyl]silane?
1-benzofuran-2-yl-dimethyl-[2-(oxan-2-yloxymethyl)phenyl]silane has a molecular weight of 366.53 g/mol, XLogP of 4.30, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzofuran-2-yl-dimethyl-[2-(oxan-2-yloxymethyl)phenyl]silane is sourced from PubChem (CID 122374661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).