trimethylsilyl 2-propyl-5-trimethylsilyloxypentanoate

C14H32O3Si2 — CID 523705

IUPACtrimethylsilyl 2-propyl-5-trimethylsilyloxypentanoate
SMILESCCCC(CCCO[Si](C)(C)C)C(=O)O[Si](C)(C)C
InChIInChI=1S/C14H32O3Si2/c1-8-10-13(14(15)17-19(5,6)7)11-9-12-16-18(2,3)4/h13H,8-12H2,1-7H3
InChIKeyWMRIPYKNUFEUSW-UHFFFAOYSA-N
MW304.58 g/mol
LogP4.41
Rot. Bonds9

About trimethylsilyl 2-propyl-5-trimethylsilyloxypentanoate

trimethylsilyl 2-propyl-5-trimethylsilyloxypentanoate (PubChem CID 523705) has the molecular formula C14H32O3Si2 and a molecular weight of 304.58 g/mol. Its IUPAC name is trimethylsilyl 2-propyl-5-trimethylsilyloxypentanoate.

Molecular Properties

Compound Nametrimethylsilyl 2-propyl-5-trimethylsilyloxypentanoate
PubChem CID523705
Molecular FormulaC14H32O3Si2
Molecular Weight304.58 g/mol
Exact Mass304.19
IUPAC Nametrimethylsilyl 2-propyl-5-trimethylsilyloxypentanoate
SMILESCCCC(CCCO[Si](C)(C)C)C(=O)O[Si](C)(C)C
InChIInChI=1S/C14H32O3Si2/c1-8-10-13(14(15)17-19(5,6)7)11-9-12-16-18(2,3)4/h13H,8-12H2,1-7H3
InChIKeyWMRIPYKNUFEUSW-UHFFFAOYSA-N
XLogP4.41
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.58
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze trimethylsilyl 2-propyl-5-trimethylsilyloxypentanoate 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

Hexane-1,3-dicarboxylic acid, bis(trimethylsilyl) ester
CID 523702
Hexanoic acid, 2-(3-hydroxypropyl), bis-TMS
CID 526138
Pentanoic acid, 4-hydroxy-2-propyl, bis-TMS, # 1
CID 526140
1,3,5-Pentanetricarboxylic acid tris(trimethylsilyl) ester
CID 101618131
Ethyl 5-[tert-butyl(dimethyl)silyl]oxy-2-[3-[tert-butyl(dimethyl)silyl]oxypropyl]pentanoate
CID 10928192

Frequently Asked Questions

What is the IUPAC name of trimethylsilyl 2-propyl-5-trimethylsilyloxypentanoate?
The IUPAC name of trimethylsilyl 2-propyl-5-trimethylsilyloxypentanoate (CID 523705) is trimethylsilyl 2-propyl-5-trimethylsilyloxypentanoate.
What is the SMILES notation for trimethylsilyl 2-propyl-5-trimethylsilyloxypentanoate?
The canonical SMILES for trimethylsilyl 2-propyl-5-trimethylsilyloxypentanoate is CCCC(CCCO[Si](C)(C)C)C(=O)O[Si](C)(C)C.
What is the InChIKey of trimethylsilyl 2-propyl-5-trimethylsilyloxypentanoate?
The InChIKey is WMRIPYKNUFEUSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H32O3Si2/c1-8-10-13(14(15)17-19(5,6)7)11-9-12-16-18(2,3)4/h13H,8-12H2,1-7H3.
What are the key properties of trimethylsilyl 2-propyl-5-trimethylsilyloxypentanoate?
trimethylsilyl 2-propyl-5-trimethylsilyloxypentanoate has a molecular weight of 304.58 g/mol, XLogP of 4.41, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethylsilyl 2-propyl-5-trimethylsilyloxypentanoate is sourced from PubChem (CID 523705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).