2-[tert-butyl(dimethyl)silyl]oxy-4-methoxybenzaldehyde

C14H22O3Si — CID 23165516

IUPAC2-[tert-butyl(dimethyl)silyl]oxy-4-methoxybenzaldehyde
SMILESCOc1ccc(C=O)c(O[Si](C)(C)C(C)(C)C)c1
InChIInChI=1S/C14H22O3Si/c1-14(2,3)18(5,6)17-13-9-12(16-4)8-7-11(13)10-15/h7-10H,1-6H3
InChIKeyMRXWTPQEYTVXDX-UHFFFAOYSA-N
MW266.41 g/mol
LogP3.89
Rot. Bonds4

About 2-[tert-butyl(dimethyl)silyl]oxy-4-methoxybenzaldehyde

2-[tert-butyl(dimethyl)silyl]oxy-4-methoxybenzaldehyde (PubChem CID 23165516) has the molecular formula C14H22O3Si and a molecular weight of 266.41 g/mol. Its IUPAC name is 2-[tert-butyl(dimethyl)silyl]oxy-4-methoxybenzaldehyde.

Molecular Properties

Compound Name2-[tert-butyl(dimethyl)silyl]oxy-4-methoxybenzaldehyde
PubChem CID23165516
Molecular FormulaC14H22O3Si
Molecular Weight266.41 g/mol
Exact Mass266.13
IUPAC Name2-[tert-butyl(dimethyl)silyl]oxy-4-methoxybenzaldehyde
SMILESCOc1ccc(C=O)c(O[Si](C)(C)C(C)(C)C)c1
InChIInChI=1S/C14H22O3Si/c1-14(2,3)18(5,6)17-13-9-12(16-4)8-7-11(13)10-15/h7-10H,1-6H3
InChIKeyMRXWTPQEYTVXDX-UHFFFAOYSA-N
XLogP3.89
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.41
LogP ≤ 53.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-[tert-butyl(dimethyl)silyl]oxy-5-methoxy-2-methylbenzaldehyde
CID 174074491
tert-butyl-(2-ethenyl-4-methoxyphenoxy)-dimethylsilane
CID 10945326
2-[tert-butyl(dimethyl)silyl]oxybenzaldehyde
CID 10900635
methyl 2-[tert-butyl(dimethyl)silyl]oxy-4-methoxybenzoate
CID 91737509
4-methoxy-2-(triaminomethoxy)benzaldehyde
CID 89196601
4-methoxy-2-(2-methylbut-3-en-2-yloxy)benzaldehyde
CID 134843951
1,4-bis[[tert-butyl(dimethyl)silyl]oxy]-5,8-dimethoxynaphthalene-2-carbaldehyde
CID 11352018
2,4-bis[[tert-butyl(dimethyl)silyl]oxy]-3-methylbenzaldehyde
CID 131734421
3-[tert-butyl(dimethyl)silyl]oxy-2-hydroxy-4-methoxybenzaldehyde
CID 11701906
2-[2-[tert-butyl(dimethyl)silyl]oxy-4,6-dimethoxyphenyl]acetaldehyde
CID 11461073
4-methoxy-2-(3-methoxyphenoxy)benzaldehyde
CID 122403845
2-(4,6-dimethoxypyrimidin-2-yl)oxy-4-methoxybenzaldehyde
CID 139643232

Frequently Asked Questions

What is the IUPAC name of 2-[tert-butyl(dimethyl)silyl]oxy-4-methoxybenzaldehyde?
The IUPAC name of 2-[tert-butyl(dimethyl)silyl]oxy-4-methoxybenzaldehyde (CID 23165516) is 2-[tert-butyl(dimethyl)silyl]oxy-4-methoxybenzaldehyde.
What is the SMILES notation for 2-[tert-butyl(dimethyl)silyl]oxy-4-methoxybenzaldehyde?
The canonical SMILES for 2-[tert-butyl(dimethyl)silyl]oxy-4-methoxybenzaldehyde is COc1ccc(C=O)c(O[Si](C)(C)C(C)(C)C)c1.
What is the InChIKey of 2-[tert-butyl(dimethyl)silyl]oxy-4-methoxybenzaldehyde?
The InChIKey is MRXWTPQEYTVXDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22O3Si/c1-14(2,3)18(5,6)17-13-9-12(16-4)8-7-11(13)10-15/h7-10H,1-6H3.
What are the key properties of 2-[tert-butyl(dimethyl)silyl]oxy-4-methoxybenzaldehyde?
2-[tert-butyl(dimethyl)silyl]oxy-4-methoxybenzaldehyde has a molecular weight of 266.41 g/mol, XLogP of 3.89, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[tert-butyl(dimethyl)silyl]oxy-4-methoxybenzaldehyde is sourced from PubChem (CID 23165516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).