Titanium, tris(isooctadecanoato-kappaO)(2-propanolato)- structure

Titanium, tris(isooctadecanoato-kappaO)(2-propanolato)-

TL;DR: Titanium, tris(isooctadecanoato-kappaO)(2-propanolato)- (CAS 61417-49-0) is a chemical compound with molecular formula C57H116O7Ti and molecular weight 960.82 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

tris(16-methylheptadecanoic acid);propan-2-ol;titanium

Also Known As: Titanium triisostearoylisopropoxide, Isopropyl titanium triisostearate, Isopropyl triisostearoyl titanate, Isopropyltriisostearoyltitanate, i-propoxytitanium triisostearate

CAS: 61417-49-0
Molecular Formula C57H116O7Ti
Molecular Weight 960.82 g/mol
LogP 18.9498
Topological Polar Surface Area 132.0 Ų
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 7
Rotatable Bonds 45
Exact Mass 960.82007
Heavy Atoms 65
Complexity 798.0

Chemical Identifiers

CAS Number 61417-49-0
SMILES CC(C)CCCCCCCCCCCCCCC(=O)O.CC(C)CCCCCCCCCCCCCCC(=O)O.CC(C)CCCCCCCCCCCCCCC(=O)O.CC(C)O.[Ti]
InChIKey IEKHISJGRIEHRE-UHFFFAOYSA-N

Product Overview

Titanium, tris(isooctadecanoato-kappaO)(2-propanolato)- (CAS 61417-49-0), with molecular formula C57H116O7Ti and molecular weight 960.82 g/mol. IUPAC: tris(16-methylheptadecanoic acid);propan-2-ol;titanium.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →

Chemical Property Profile of Titanium, tris(isooctadecanoato-kappaO)(2-propanolato)-

XLogP
18.9498
TPSA (Topological Polar Surface Area)
132.0
Hydrogen Bond Donors
4
Hydrogen Bond Acceptors
7
Rotatable Bonds
45
Heavy Atoms
65
Complexity
798.0
Exact Mass
960.82007
Monoisotopic Mass
960.82007
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Titanium, tris(isooctadecanoato-kappaO)(2-propanolato)-

The XLogP value of 18.9498 indicates that Titanium, tris(isooctadecanoato-kappaO)(2-propanolato)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 132.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Titanium, tris(isooctadecanoato-kappaO)(2-propanolato)-. Following Lipinski's Rule of Five, Titanium, tris(isooctadecanoato-kappaO)(2-propanolato)- has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of Titanium, tris(isooctadecanoato-kappaO)(2-propanolato)-?

The CAS number of Titanium, tris(isooctadecanoato-kappaO)(2-propanolato)- is 61417-49-0.

What is the molecular formula of Titanium, tris(isooctadecanoato-kappaO)(2-propanolato)-?

The molecular formula of Titanium, tris(isooctadecanoato-kappaO)(2-propanolato)- is C57H116O7Ti.

What is the molecular weight of Titanium, tris(isooctadecanoato-kappaO)(2-propanolato)-?

The molecular weight of Titanium, tris(isooctadecanoato-kappaO)(2-propanolato)- is 960.82 g/mol.

Where can I buy Titanium, tris(isooctadecanoato-kappaO)(2-propanolato)-?

You can request a quote for Titanium, tris(isooctadecanoato-kappaO)(2-propanolato)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for Titanium, tris(isooctadecanoato-kappaO)(2-propanolato)-?

Yes, KEHONG BIO provides custom synthesis services for Titanium, tris(isooctadecanoato-kappaO)(2-propanolato)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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