trimethylsilyl 2-trimethylsilyloxyoctanoate

C14H32O3Si2 — CID 91730031

IUPACtrimethylsilyl 2-trimethylsilyloxyoctanoate
SMILESCCCCCCC(O[Si](C)(C)C)C(=O)O[Si](C)(C)C
InChIInChI=1S/C14H32O3Si2/c1-8-9-10-11-12-13(16-18(2,3)4)14(15)17-19(5,6)7/h13H,8-12H2,1-7H3
InChIKeyGMIHMOPIXUPKIA-UHFFFAOYSA-N
MW304.58 g/mol
LogP4.55
Rot. Bonds9

About trimethylsilyl 2-trimethylsilyloxyoctanoate

trimethylsilyl 2-trimethylsilyloxyoctanoate (PubChem CID 91730031) has the molecular formula C14H32O3Si2 and a molecular weight of 304.58 g/mol. Its IUPAC name is trimethylsilyl 2-trimethylsilyloxyoctanoate.

Molecular Properties

Compound Nametrimethylsilyl 2-trimethylsilyloxyoctanoate
PubChem CID91730031
Molecular FormulaC14H32O3Si2
Molecular Weight304.58 g/mol
Exact Mass304.19
IUPAC Nametrimethylsilyl 2-trimethylsilyloxyoctanoate
SMILESCCCCCCC(O[Si](C)(C)C)C(=O)O[Si](C)(C)C
InChIInChI=1S/C14H32O3Si2/c1-8-9-10-11-12-13(16-18(2,3)4)14(15)17-19(5,6)7/h13H,8-12H2,1-7H3
InChIKeyGMIHMOPIXUPKIA-UHFFFAOYSA-N
XLogP4.55
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 ≤ 54.55
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'}

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Related Compounds

methyl 2-trimethylsilyloxyhexadecanoate
CID 524469
trimethylsilyl (2S,3S)-2-trimethylsilyl-3-trimethylsilyloxydecanoate
CID 101121224
bis(trimethylsilyl) (2S,4R)-2,4-bis(trimethylsilyloxy)pentanedioate
CID 523360
6-trimethylsilyloxydecan-5-one
CID 101053254
butyl 2-trimethylsilyloxypropanoate
CID 88549339
2-[butyl(dimethyl)silyl]oxyhexadecanoic acid
CID 87408863
2-bromooxyheptanoic acid
CID 151321599
trimethylsilyl 8-methyltetradecanoate
CID 526098
trimethylsilyl 10-methyltricosanoate
CID 91747658
methyl (Z,5R)-2-hexyl-3,5-bis(trimethylsilyloxy)hexadec-3-enoate
CID 11432529
3-[tert-butyl(dimethyl)silyl]oxyoctadecan-2-one
CID 46237114
methyl 8-trimethylsilyloxyhexadecanoate
CID 14454572

Frequently Asked Questions

What is the IUPAC name of trimethylsilyl 2-trimethylsilyloxyoctanoate?
The IUPAC name of trimethylsilyl 2-trimethylsilyloxyoctanoate (CID 91730031) is trimethylsilyl 2-trimethylsilyloxyoctanoate.
What is the SMILES notation for trimethylsilyl 2-trimethylsilyloxyoctanoate?
The canonical SMILES for trimethylsilyl 2-trimethylsilyloxyoctanoate is CCCCCCC(O[Si](C)(C)C)C(=O)O[Si](C)(C)C.
What is the InChIKey of trimethylsilyl 2-trimethylsilyloxyoctanoate?
The InChIKey is GMIHMOPIXUPKIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H32O3Si2/c1-8-9-10-11-12-13(16-18(2,3)4)14(15)17-19(5,6)7/h13H,8-12H2,1-7H3.
What are the key properties of trimethylsilyl 2-trimethylsilyloxyoctanoate?
trimethylsilyl 2-trimethylsilyloxyoctanoate has a molecular weight of 304.58 g/mol, XLogP of 4.55, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethylsilyl 2-trimethylsilyloxyoctanoate is sourced from PubChem (CID 91730031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).