trimethylsilyl 2,3,4,5-tetrakis(trimethylsilyloxy)-2-(trimethylsilyloxymethyl)pentanoate

C24H60O7Si6 — CID 523321

IUPACtrimethylsilyl 2,3,4,5-tetrakis(trimethylsilyloxy)-2-(trimethylsilyloxymethyl)pentanoate
SMILESC[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(CO[Si](C)(C)C)(O[Si](C)(C)C)C(=O)O[Si](C)(C)C
InChIInChI=1S/C24H60O7Si6/c1-32(2,3)26-19-21(28-34(7,8)9)22(29-35(10,11)12)24(31-37(16,17)18,20-27-33(4,5)6)23(25)30-36(13,14)15/h21-22H,19-20H2,1-18H3
InChIKeyKGHUMIAEJNYKKE-UHFFFAOYSA-N
MW629.25 g/mol
LogP7.10
Rot. Bonds16

About trimethylsilyl 2,3,4,5-tetrakis(trimethylsilyloxy)-2-(trimethylsilyloxymethyl)pentanoate

trimethylsilyl 2,3,4,5-tetrakis(trimethylsilyloxy)-2-(trimethylsilyloxymethyl)pentanoate (PubChem CID 523321) has the molecular formula C24H60O7Si6 and a molecular weight of 629.25 g/mol. Its IUPAC name is trimethylsilyl 2,3,4,5-tetrakis(trimethylsilyloxy)-2-(trimethylsilyloxymethyl)pentanoate.

Molecular Properties

Compound Nametrimethylsilyl 2,3,4,5-tetrakis(trimethylsilyloxy)-2-(trimethylsilyloxymethyl)pentanoate
PubChem CID523321
Molecular FormulaC24H60O7Si6
Molecular Weight629.25 g/mol
Exact Mass628.30
IUPAC Nametrimethylsilyl 2,3,4,5-tetrakis(trimethylsilyloxy)-2-(trimethylsilyloxymethyl)pentanoate
SMILESC[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(CO[Si](C)(C)C)(O[Si](C)(C)C)C(=O)O[Si](C)(C)C
InChIInChI=1S/C24H60O7Si6/c1-32(2,3)26-19-21(28-34(7,8)9)22(29-35(10,11)12)24(31-37(16,17)18,20-27-33(4,5)6)23(25)30-36(13,14)15/h21-22H,19-20H2,1-18H3
InChIKeyKGHUMIAEJNYKKE-UHFFFAOYSA-N
XLogP7.10
TPSA72.45 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds16
Heavy Atoms37
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500629.25
LogP ≤ 57.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze trimethylsilyl 2,3,4,5-tetrakis(trimethylsilyloxy)-2-(trimethylsilyloxymethyl)pentanoate 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

1,2,3-Propanetricarboxylic acid, 2-[(trimethylsilyl)oxy]-, tris(trimethylsilyl) ester
CID 553132
2-C-Methylribonic acid, 1,4-lactone, TMS
CID 91064241
Methyl [(isopropoxycarbonyl)disulfanyl]acetate
CID 523775
1,2,3-Propanetricarboxylic acid, 2-[(tert-butyldimethylsilyl)oxy]-, tris(tert-butyldimethylsilyl) ester
CID 528571
1,2,3-Propanetricarboxylic acid, 1-[(trimethylsilyl)oxy]-, tris(trimethylsilyl) ester
CID 528659
Methylcitric acid, tetrakis(trimethylsilyl) deriv.
CID 530815
Ribonic acid, 2-C-methyl-2,3,4,5-tetrakis-O-(trimethylsilyl)-, trimethylsilyl ester
CID 552768
2-Ethyl 1,3-bis(trimethylsilyl) 2-((trimethylsilyl)oxy)propane-1,2,3-tricarboxylate
CID 553684
Erythro-Pentonic acid, 3-deoxy-2,4,5-tris-O-(trimethylsilyl)-2-C-[[(trimethylsilyl)oxy]methyl]-, trimethylsilyl ester
CID 553971
2-Hydroxyglutarate, TBDMS
CID 634802
Arabinonic acid, pentakis-TMS
CID 523307
2-C-Methylarabinonic acid, pentakis-TMS
CID 523323

Frequently Asked Questions

What is the IUPAC name of trimethylsilyl 2,3,4,5-tetrakis(trimethylsilyloxy)-2-(trimethylsilyloxymethyl)pentanoate?
The IUPAC name of trimethylsilyl 2,3,4,5-tetrakis(trimethylsilyloxy)-2-(trimethylsilyloxymethyl)pentanoate (CID 523321) is trimethylsilyl 2,3,4,5-tetrakis(trimethylsilyloxy)-2-(trimethylsilyloxymethyl)pentanoate.
What is the SMILES notation for trimethylsilyl 2,3,4,5-tetrakis(trimethylsilyloxy)-2-(trimethylsilyloxymethyl)pentanoate?
The canonical SMILES for trimethylsilyl 2,3,4,5-tetrakis(trimethylsilyloxy)-2-(trimethylsilyloxymethyl)pentanoate is C[Si](C)(C)OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(CO[Si](C)(C)C)(O[Si](C)(C)C)C(=O)O[Si](C)(C)C.
What is the InChIKey of trimethylsilyl 2,3,4,5-tetrakis(trimethylsilyloxy)-2-(trimethylsilyloxymethyl)pentanoate?
The InChIKey is KGHUMIAEJNYKKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H60O7Si6/c1-32(2,3)26-19-21(28-34(7,8)9)22(29-35(10,11)12)24(31-37(16,17)18,20-27-33(4,5)6)23(25)30-36(13,14)15/h21-22H,19-20H2,1-18H3.
What are the key properties of trimethylsilyl 2,3,4,5-tetrakis(trimethylsilyloxy)-2-(trimethylsilyloxymethyl)pentanoate?
trimethylsilyl 2,3,4,5-tetrakis(trimethylsilyloxy)-2-(trimethylsilyloxymethyl)pentanoate has a molecular weight of 629.25 g/mol, XLogP of 7.10, 16 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for trimethylsilyl 2,3,4,5-tetrakis(trimethylsilyloxy)-2-(trimethylsilyloxymethyl)pentanoate is sourced from PubChem (CID 523321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).