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Titanium, tris(6-aminohexanoato-kappaO)(2-propanolato)-, (T-4)- structure
Fine Chemical

Titanium, tris(6-aminohexanoato-kappaO)(2-propanolato)-, (T-4)-

TL;DR: Titanium, tris(6-aminohexanoato-kappaO)(2-propanolato)-, (T-4)- (CAS 68443-51-6) is a chemical compound with molecular formula C21H47N3O7Ti and molecular weight 501.28934 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

tris(6-aminohexanoic acid);propan-2-ol;titanium

Also Known As: Isopropyl tri(6-aminocaproyl) titanate, Tris(6-aminohexanoato-O)(propan-2-olato)titanium, Titanium, tris(6-aminohexanoato-kappaO)(2-propanolato)-, (T-4)-, Titanium, tris(6-aminohexanoato-.kappa.O)(2-propanolato)-, (T-4)-, EINECS 270-530-7

CAS Number
68443-51-6
Molecular Formula
C21H47N3O7Ti
Molecular Weight
501.28934 g/mol
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Technical Specifications

Molecular FormulaC21H47N3O7Ti
Molecular Weight501.28934 g/mol
XLogP2.15
Topological Polar Surface Area (TPSA)210.0 Ų
Hydrogen Bond Donors7
Hydrogen Bond Acceptors10
Rotatable Bonds15
Exact Mass501.28934 Da
Heavy Atoms32
Complexity349.0
SMILESCC(C)O.C(CCC(=O)O)CCN.C(CCC(=O)O)CCN.C(CCC(=O)O)CCN.[Ti]
InChIKeyYWICBDKQDBLMON-UHFFFAOYSA-N

Chemical Property Profile of Titanium, tris(6-aminohexanoato-kappaO)(2-propanolato)-, (T-4)-

XLogP
2.15
TPSA (Topological Polar Surface Area)
210.0
Hydrogen Bond Donors
7
Hydrogen Bond Acceptors
10
Rotatable Bonds
15
Heavy Atoms
32
Complexity
349.0
Exact Mass
501.28934
Monoisotopic Mass
501.28934
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(6-aminohexanoato-kappaO)(2-propanolato)-, (T-4)-

The XLogP value of 2.15 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Titanium, tris(6-aminohexanoato-kappaO)(2-propanolato)-, (T-4)-. The TPSA of 210.0 Ų indicates high polarity, suggesting Titanium, tris(6-aminohexanoato-kappaO)(2-propanolato)-, (T-4)- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Titanium, tris(6-aminohexanoato-kappaO)(2-propanolato)-, (T-4)- has 7 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Titanium, tris(6-aminohexanoato-kappaO)(2-propanolato)-, (T-4)-?

The CAS number of Titanium, tris(6-aminohexanoato-kappaO)(2-propanolato)-, (T-4)- is 68443-51-6.

What is the molecular formula of Titanium, tris(6-aminohexanoato-kappaO)(2-propanolato)-, (T-4)-?

The molecular formula of Titanium, tris(6-aminohexanoato-kappaO)(2-propanolato)-, (T-4)- is C21H47N3O7Ti.

What is the molecular weight of Titanium, tris(6-aminohexanoato-kappaO)(2-propanolato)-, (T-4)-?

The molecular weight of Titanium, tris(6-aminohexanoato-kappaO)(2-propanolato)-, (T-4)- is 501.28934 g/mol.

Where can I buy Titanium, tris(6-aminohexanoato-kappaO)(2-propanolato)-, (T-4)-?

You can request a quote for Titanium, tris(6-aminohexanoato-kappaO)(2-propanolato)-, (T-4)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Titanium, tris(6-aminohexanoato-kappaO)(2-propanolato)-, (T-4)-?

Yes, CoreyChem provides custom synthesis services for Titanium, tris(6-aminohexanoato-kappaO)(2-propanolato)-, (T-4)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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