2-[(5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]oxolan-2-yl]acetaldehyde

C13H26O3Si — CID 162717514

IUPAC2-[(5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]oxolan-2-yl]acetaldehyde
SMILESCC(C)(C)[Si](C)(C)OC[C@H]1CCC(CC=O)O1
InChIInChI=1S/C13H26O3Si/c1-13(2,3)17(4,5)15-10-12-7-6-11(16-12)8-9-14/h9,11-12H,6-8,10H2,1-5H3/t11?,12-/m1/s1
InChIKeyWDXVADLHBHZIHL-PIJUOVFKSA-N
MW258.43 g/mol
LogP3.14
Rot. Bonds5

About 2-[(5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]oxolan-2-yl]acetaldehyde

2-[(5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]oxolan-2-yl]acetaldehyde (PubChem CID 162717514) has the molecular formula C13H26O3Si and a molecular weight of 258.43 g/mol. Its IUPAC name is 2-[(5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]oxolan-2-yl]acetaldehyde.

Molecular Properties

Compound Name2-[(5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]oxolan-2-yl]acetaldehyde
PubChem CID162717514
Molecular FormulaC13H26O3Si
Molecular Weight258.43 g/mol
Exact Mass258.17
IUPAC Name2-[(5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]oxolan-2-yl]acetaldehyde
SMILESCC(C)(C)[Si](C)(C)OC[C@H]1CCC(CC=O)O1
InChIInChI=1S/C13H26O3Si/c1-13(2,3)17(4,5)15-10-12-7-6-11(16-12)8-9-14/h9,11-12H,6-8,10H2,1-5H3/t11?,12-/m1/s1
InChIKeyWDXVADLHBHZIHL-PIJUOVFKSA-N
XLogP3.14
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.43
LogP ≤ 53.14
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'}

Analyze 2-[(5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]oxolan-2-yl]acetaldehyde with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

tert-butyl-dimethyl-[[(2R,5R)-5-prop-2-enyloxolan-2-yl]methoxy]silane
CID 71665104
2-[(2S,5R,6S)-6-[tert-butyl(dimethyl)silyl]oxy-5-methyloxan-2-yl]acetaldehyde
CID 10967662
methyl 2-[(2R,6S)-6-[[tert-butyl(dimethyl)silyl]oxymethyl]oxan-2-yl]acetate
CID 15347120
tert-butyl-[[(2S)-6-ethoxyoxan-2-yl]methoxy]-dimethylsilane
CID 139257646
tert-butyl-dimethyl-[[(2S,5R)-5-phenylsulfanyloxolan-2-yl]methoxy]silane
CID 102383882
2-[(2R,4S,6R)-4-[tert-butyl(dimethyl)silyl]oxy-6-[(2R)-2-methylbut-3-enyl]oxan-2-yl]acetaldehyde
CID 102134604
[(2R,5R)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]oxolan-2-yl]methanol
CID 11459641
tert-butyl-(1,3-dioxolan-4-ylmethoxy)-dimethylsilane
CID 152706381
4-[[tert-butyl(dimethyl)silyl]oxymethyl]cyclohexan-1-one
CID 59734106
4-[[tert-butyl(dimethyl)silyl]oxymethyl]cyclohexan-1-amine
CID 170953372
2-[(2R,6R)-6-[[tert-butyl(diphenyl)silyl]oxymethyl]-2-methyl-1,3-dioxan-4-yl]acetaldehyde
CID 134945356
2-[(2S,4aS,8aS)-3,4-bis[[tert-butyl(dimethyl)silyl]oxy]-2-[(E,1S)-1-[tert-butyl(dimethyl)silyl]oxy-3-iodoprop-2-enyl]-2,3,4,4a,6,7,8,8a-octahydropyrano[3,2-b]pyran-6-yl]acetaldehyde
CID 134692437

Frequently Asked Questions

What is the IUPAC name of 2-[(5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]oxolan-2-yl]acetaldehyde?
The IUPAC name of 2-[(5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]oxolan-2-yl]acetaldehyde (CID 162717514) is 2-[(5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]oxolan-2-yl]acetaldehyde.
What is the SMILES notation for 2-[(5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]oxolan-2-yl]acetaldehyde?
The canonical SMILES for 2-[(5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]oxolan-2-yl]acetaldehyde is CC(C)(C)[Si](C)(C)OC[C@H]1CCC(CC=O)O1.
What is the InChIKey of 2-[(5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]oxolan-2-yl]acetaldehyde?
The InChIKey is WDXVADLHBHZIHL-PIJUOVFKSA-N. The full InChI is InChI=1S/C13H26O3Si/c1-13(2,3)17(4,5)15-10-12-7-6-11(16-12)8-9-14/h9,11-12H,6-8,10H2,1-5H3/t11?,12-/m1/s1.
What are the key properties of 2-[(5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]oxolan-2-yl]acetaldehyde?
2-[(5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]oxolan-2-yl]acetaldehyde has a molecular weight of 258.43 g/mol, XLogP of 3.14, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]oxolan-2-yl]acetaldehyde is sourced from PubChem (CID 162717514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).