4-[tert-butyl(diphenyl)silyl]oxy-3-methoxybenzaldehyde

C24H26O3Si — CID 11395179

IUPAC4-[tert-butyl(diphenyl)silyl]oxy-3-methoxybenzaldehyde
SMILESCOc1cc(C=O)ccc1O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C24H26O3Si/c1-24(2,3)28(20-11-7-5-8-12-20,21-13-9-6-10-14-21)27-22-16-15-19(18-25)17-23(22)26-4/h5-18H,1-4H3
InChIKeyUSCDCAWKPKSVCW-UHFFFAOYSA-N
MW390.56 g/mol
LogP4.45
Rot. Bonds6

About 4-[tert-butyl(diphenyl)silyl]oxy-3-methoxybenzaldehyde

4-[tert-butyl(diphenyl)silyl]oxy-3-methoxybenzaldehyde (PubChem CID 11395179) has the molecular formula C24H26O3Si and a molecular weight of 390.56 g/mol. Its IUPAC name is 4-[tert-butyl(diphenyl)silyl]oxy-3-methoxybenzaldehyde.

Molecular Properties

Compound Name4-[tert-butyl(diphenyl)silyl]oxy-3-methoxybenzaldehyde
PubChem CID11395179
Molecular FormulaC24H26O3Si
Molecular Weight390.56 g/mol
Exact Mass390.17
IUPAC Name4-[tert-butyl(diphenyl)silyl]oxy-3-methoxybenzaldehyde
SMILESCOc1cc(C=O)ccc1O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C24H26O3Si/c1-24(2,3)28(20-11-7-5-8-12-20,21-13-9-6-10-14-21)27-22-16-15-19(18-25)17-23(22)26-4/h5-18H,1-4H3
InChIKeyUSCDCAWKPKSVCW-UHFFFAOYSA-N
XLogP4.45
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.56
LogP ≤ 54.45
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

N-[2-amino-5-[tert-butyl(diphenyl)silyl]oxy-4-methoxyphenyl]formamide
CID 58622914
[5-[(E)-2-(3-bromo-4,5-dimethoxyphenyl)ethenyl]-2-methoxyphenoxy]-tert-butyl-diphenylsilane
CID 11635755
2,4-bis[[tert-butyl(diphenyl)silyl]oxy]benzaldehyde
CID 44598255
N-[5-[tert-butyl(diphenyl)silyl]oxy-4-methoxy-2-nitrophenyl]formamide
CID 58622923
4-(4-formyl-2-methoxyphenoxy)phosphanyloxy-3-methoxybenzaldehyde
CID 58610952
3-methoxy-4-phenylmethoxybenzaldehyde
CID 161042191
3-methoxy-4-[2-(2-methoxyphenoxy)ethoxy]benzaldehyde
CID 3738735
tert-butyl-[(6-methoxy-3H-benzimidazol-5-yl)oxy]-diphenylsilane
CID 57431359
4-benzylperoxy-3-methoxybenzaldehyde
CID 126613899
3-tert-butyl-4-methoxybenzaldehyde
CID 3774604
methyl 5-[tert-butyl(diphenyl)silyl]oxy-3-methoxynaphthalene-2-carboxylate
CID 140692804
(4-formyl-2-methoxyphenyl) methanesulfonate
CID 3650004

Frequently Asked Questions

What is the IUPAC name of 4-[tert-butyl(diphenyl)silyl]oxy-3-methoxybenzaldehyde?
The IUPAC name of 4-[tert-butyl(diphenyl)silyl]oxy-3-methoxybenzaldehyde (CID 11395179) is 4-[tert-butyl(diphenyl)silyl]oxy-3-methoxybenzaldehyde.
What is the SMILES notation for 4-[tert-butyl(diphenyl)silyl]oxy-3-methoxybenzaldehyde?
The canonical SMILES for 4-[tert-butyl(diphenyl)silyl]oxy-3-methoxybenzaldehyde is COc1cc(C=O)ccc1O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C.
What is the InChIKey of 4-[tert-butyl(diphenyl)silyl]oxy-3-methoxybenzaldehyde?
The InChIKey is USCDCAWKPKSVCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26O3Si/c1-24(2,3)28(20-11-7-5-8-12-20,21-13-9-6-10-14-21)27-22-16-15-19(18-25)17-23(22)26-4/h5-18H,1-4H3.
What are the key properties of 4-[tert-butyl(diphenyl)silyl]oxy-3-methoxybenzaldehyde?
4-[tert-butyl(diphenyl)silyl]oxy-3-methoxybenzaldehyde has a molecular weight of 390.56 g/mol, XLogP of 4.45, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[tert-butyl(diphenyl)silyl]oxy-3-methoxybenzaldehyde is sourced from PubChem (CID 11395179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).