4-[tert-butyl(dimethyl)silyl]oxy-6-[tert-butyl(diphenyl)silyl]oxyhexanal

C28H44O3Si2 — CID 11420340

IUPAC4-[tert-butyl(dimethyl)silyl]oxy-6-[tert-butyl(diphenyl)silyl]oxyhexanal
SMILESCC(C)(C)[Si](C)(C)OC(CCC=O)CCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C28H44O3Si2/c1-27(2,3)32(7,8)31-24(16-15-22-29)21-23-30-33(28(4,5)6,25-17-11-9-12-18-25)26-19-13-10-14-20-26/h9-14,17-20,22,24H,15-16,21,23H2,1-8H3
InChIKeyAGOSZUZCCPUFMD-UHFFFAOYSA-N
MW484.83 g/mol
LogP6.32
Rot. Bonds11

About 4-[tert-butyl(dimethyl)silyl]oxy-6-[tert-butyl(diphenyl)silyl]oxyhexanal

4-[tert-butyl(dimethyl)silyl]oxy-6-[tert-butyl(diphenyl)silyl]oxyhexanal (PubChem CID 11420340) has the molecular formula C28H44O3Si2 and a molecular weight of 484.83 g/mol. Its IUPAC name is 4-[tert-butyl(dimethyl)silyl]oxy-6-[tert-butyl(diphenyl)silyl]oxyhexanal.

Molecular Properties

Compound Name4-[tert-butyl(dimethyl)silyl]oxy-6-[tert-butyl(diphenyl)silyl]oxyhexanal
PubChem CID11420340
Molecular FormulaC28H44O3Si2
Molecular Weight484.83 g/mol
Exact Mass484.28
IUPAC Name4-[tert-butyl(dimethyl)silyl]oxy-6-[tert-butyl(diphenyl)silyl]oxyhexanal
SMILESCC(C)(C)[Si](C)(C)OC(CCC=O)CCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C28H44O3Si2/c1-27(2,3)32(7,8)31-24(16-15-22-29)21-23-30-33(28(4,5)6,25-17-11-9-12-18-25)26-19-13-10-14-20-26/h9-14,17-20,22,24H,15-16,21,23H2,1-8H3
InChIKeyAGOSZUZCCPUFMD-UHFFFAOYSA-N
XLogP6.32
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500484.83
LogP ≤ 56.32
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

7-[tert-butyl(dimethyl)silyl]oxy-9-[tert-butyl(diphenyl)silyl]oxy-4-triethylsilyloxynonanal
CID 11388220
tert-butyl-[1-[tert-butyl(dimethyl)silyl]oxyundecan-3-yloxy]-diphenylsilane
CID 156806459
tert-butyl-[(3S)-1-[tert-butyl(dimethyl)silyl]oxyhept-5-en-3-yl]oxy-diphenylsilane
CID 91526312
tert-butyl-[3-[tert-butyl(dimethyl)silyl]oxy-4-(9H-carbazol-4-yloxy)butoxy]-diphenylsilane
CID 72711822
3-[3-[3-[tert-butyl(diphenyl)silyl]oxypropoxy]propoxy]propanal
CID 171538124
tert-butyl-[(E,3S)-1-[tert-butyl(dimethyl)silyl]oxy-5-iodohex-4-en-3-yl]oxy-diphenylsilane
CID 56931226
(E,2S,3S)-2-[tert-butyl(dimethyl)silyl]oxy-7-[tert-butyl(diphenyl)silyl]oxyhept-4-en-3-ol
CID 102257239
(5S)-5-[tert-butyl(diphenyl)silyl]oxyhexanal
CID 24755231
5-[tert-butyl(diphenyl)silyl]oxy-2-methylpentanal
CID 72966538
tert-butyl-(3,3-dimethoxypropoxy)-diphenylsilane
CID 11142897
tert-butyl-[(3S)-5-[tert-butyl(dimethyl)silyl]oxypent-1-yn-3-yl]oxy-diphenylsilane
CID 155932039
5-[tert-butyl(diphenyl)silyl]oxy-3-[(4-methoxyphenyl)methoxy]pentanal
CID 75162787

Frequently Asked Questions

What is the IUPAC name of 4-[tert-butyl(dimethyl)silyl]oxy-6-[tert-butyl(diphenyl)silyl]oxyhexanal?
The IUPAC name of 4-[tert-butyl(dimethyl)silyl]oxy-6-[tert-butyl(diphenyl)silyl]oxyhexanal (CID 11420340) is 4-[tert-butyl(dimethyl)silyl]oxy-6-[tert-butyl(diphenyl)silyl]oxyhexanal.
What is the SMILES notation for 4-[tert-butyl(dimethyl)silyl]oxy-6-[tert-butyl(diphenyl)silyl]oxyhexanal?
The canonical SMILES for 4-[tert-butyl(dimethyl)silyl]oxy-6-[tert-butyl(diphenyl)silyl]oxyhexanal is CC(C)(C)[Si](C)(C)OC(CCC=O)CCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C.
What is the InChIKey of 4-[tert-butyl(dimethyl)silyl]oxy-6-[tert-butyl(diphenyl)silyl]oxyhexanal?
The InChIKey is AGOSZUZCCPUFMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H44O3Si2/c1-27(2,3)32(7,8)31-24(16-15-22-29)21-23-30-33(28(4,5)6,25-17-11-9-12-18-25)26-19-13-10-14-20-26/h9-14,17-20,22,24H,15-16,21,23H2,1-8H3.
What are the key properties of 4-[tert-butyl(dimethyl)silyl]oxy-6-[tert-butyl(diphenyl)silyl]oxyhexanal?
4-[tert-butyl(dimethyl)silyl]oxy-6-[tert-butyl(diphenyl)silyl]oxyhexanal has a molecular weight of 484.83 g/mol, XLogP of 6.32, 11 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[tert-butyl(dimethyl)silyl]oxy-6-[tert-butyl(diphenyl)silyl]oxyhexanal is sourced from PubChem (CID 11420340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).