1-Propene-1,2,3-tricarboxylic acid, tris(trimethylsilyl) ester, (E)-
TL;DR: 1-Propene-1,2,3-tricarboxylic acid, tris(trimethylsilyl) ester, (E)- (CAS 55530-72-8) is a chemical compound with molecular formula C15H30O6Si3 and molecular weight 390.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tris(trimethylsilyl) (E)-prop-1-ene-1,2,3-tricarboxylate
Also Known As: Aconitic acid, TMS, cis-Aconitic acid (tms), (E)-Aconitic acid, TMS, trans-Aconitic acid (3TMS), (E)-Aconitic acid, tris-TMS
| Molecular Formula | C15H30O6Si3 |
|---|---|
| Molecular Weight | 390.13 g/mol |
| LogP | 3.4372 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 390.135 |
| Heavy Atoms | 24 |
| Complexity | 520.79816 |
Chemical Identifiers
| CAS Number | 55530-72-8 |
|---|---|
| SMILES | C[Si](C)(C)OC(=O)C/C(=C\C(=O)O[Si](C)(C)C)/C(=O)O[Si](C)(C)C |
Product Overview
1-Propene-1,2,3-tricarboxylic acid, tris(trimethylsilyl) ester, (E)- (CAS 55530-72-8), with molecular formula C15H30O6Si3 and molecular weight 390.13 g/mol. IUPAC: tris(trimethylsilyl) (E)-prop-1-ene-1,2,3-tricarboxylate.
Chemical Property Profile of 1-Propene-1,2,3-tricarboxylic acid, tris(trimethylsilyl) ester, (E)-
Property Insights of 1-Propene-1,2,3-tricarboxylic acid, tris(trimethylsilyl) ester, (E)-
The XLogP value of 3.4372 indicates that 1-Propene-1,2,3-tricarboxylic acid, tris(trimethylsilyl) ester, (E)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Propene-1,2,3-tricarboxylic acid, tris(trimethylsilyl) ester, (E)-. Following Lipinski's Rule of Five, 1-Propene-1,2,3-tricarboxylic acid, tris(trimethylsilyl) ester, (E)- has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Propene-1,2,3-tricarboxylic acid, tris(trimethylsilyl) ester, (E)-?
The CAS number of 1-Propene-1,2,3-tricarboxylic acid, tris(trimethylsilyl) ester, (E)- is 55530-72-8.
What is the molecular formula of 1-Propene-1,2,3-tricarboxylic acid, tris(trimethylsilyl) ester, (E)-?
The molecular formula of 1-Propene-1,2,3-tricarboxylic acid, tris(trimethylsilyl) ester, (E)- is C15H30O6Si3.
What is the molecular weight of 1-Propene-1,2,3-tricarboxylic acid, tris(trimethylsilyl) ester, (E)-?
The molecular weight of 1-Propene-1,2,3-tricarboxylic acid, tris(trimethylsilyl) ester, (E)- is 390.13 g/mol.
Where can I buy 1-Propene-1,2,3-tricarboxylic acid, tris(trimethylsilyl) ester, (E)-?
You can request a quote for 1-Propene-1,2,3-tricarboxylic acid, tris(trimethylsilyl) ester, (E)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Propene-1,2,3-tricarboxylic acid, tris(trimethylsilyl) ester, (E)-?
Yes, KEHONG BIO provides custom synthesis services for 1-Propene-1,2,3-tricarboxylic acid, tris(trimethylsilyl) ester, (E)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.