Titanium(IV), pi-cyclopentadienyldichloro(phenylthiolato)-
TL;DR: Titanium(IV), pi-cyclopentadienyldichloro(phenylthiolato)- (CAS 37951-49-8) is a chemical compound with molecular formula C11H10Cl2STi and molecular weight 291.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzenethiolate;cyclopenta-1,3-diene;titanium(4+);dichloride
Also Known As: pi-Cyclopentadienyldichloro(phenylthiolato)titanium(IV), Titanium(IV), pi-cyclopentadienyldichloro(phenylthiolato)-, Thiophenolato-dichloro-(eta(sup 5)-cyclopentadienyl)titan(IV), titanium(4+) chloride benzenethiolate cyclopenta-2,4-dienide(1:2:1:1), Thiophenolato-dichloro-(eta(sup 5)-cyclopentadienyl)titan(IV) [German]
| Molecular Formula | C11H10Cl2STi |
|---|---|
| Molecular Weight | 291.94 g/mol |
| LogP | -2.9966 |
| Topological Polar Surface Area | 1.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 291.93597 |
| Heavy Atoms | 15 |
| Complexity | 57.0 |
Chemical Identifiers
| CAS Number | 37951-49-8 |
|---|---|
| SMILES | [CH-]1C=CC=C1.C1=CC=C(C=C1)[S-].[Cl-].[Cl-].[Ti+4] |
| InChIKey | KKOJXGXTQNEPRX-UHFFFAOYSA-K |
Product Overview
Titanium(IV), pi-cyclopentadienyldichloro(phenylthiolato)- (CAS 37951-49-8), with molecular formula C11H10Cl2STi and molecular weight 291.94 g/mol. IUPAC: benzenethiolate;cyclopenta-1,3-diene;titanium(4+);dichloride.
Chemical Property Profile of Titanium(IV), pi-cyclopentadienyldichloro(phenylthiolato)-
Property Insights of Titanium(IV), pi-cyclopentadienyldichloro(phenylthiolato)-
The XLogP value of -2.9966 indicates that Titanium(IV), pi-cyclopentadienyldichloro(phenylthiolato)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 1.0 Ų, Titanium(IV), pi-cyclopentadienyldichloro(phenylthiolato)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Titanium(IV), pi-cyclopentadienyldichloro(phenylthiolato)- has 0 hydrogen bond donor(s) and 4 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 Titanium(IV), pi-cyclopentadienyldichloro(phenylthiolato)-?
The CAS number of Titanium(IV), pi-cyclopentadienyldichloro(phenylthiolato)- is 37951-49-8.
What is the molecular formula of Titanium(IV), pi-cyclopentadienyldichloro(phenylthiolato)-?
The molecular formula of Titanium(IV), pi-cyclopentadienyldichloro(phenylthiolato)- is C11H10Cl2STi.
What is the molecular weight of Titanium(IV), pi-cyclopentadienyldichloro(phenylthiolato)-?
The molecular weight of Titanium(IV), pi-cyclopentadienyldichloro(phenylthiolato)- is 291.94 g/mol.
Where can I buy Titanium(IV), pi-cyclopentadienyldichloro(phenylthiolato)-?
You can request a quote for Titanium(IV), pi-cyclopentadienyldichloro(phenylthiolato)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Titanium(IV), pi-cyclopentadienyldichloro(phenylthiolato)-?
Yes, KEHONG BIO provides custom synthesis services for Titanium(IV), pi-cyclopentadienyldichloro(phenylthiolato)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.