二茂钛
TL;DR: 二茂钛 (CAS 1271-29-0) is a chemical compound with molecular formula C10H10Ti and molecular weight 178.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二茂钛
bis(cyclopenta-1,3-diene);titanium(2+)
Also Known As: Titanocene, Dicyclopentadienyltitanium, Titanium dicyclopentadienyl-, Di-pi-cyclopentadienyl-titanium, cyclopenta-1,3-diene;titanium(2+)
| Molecular Formula | C10H10Ti |
|---|---|
| Molecular Weight | 178.03 g/mol |
| LogP | 2.81 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 178.02618 |
| Heavy Atoms | 11 |
| Complexity | 11.0 |
Chemical Identifiers
| CAS Number | 1271-29-0 |
|---|---|
| SMILES | [CH-]1C=CC=C1.[CH-]1C=CC=C1.[Ti+2] |
| InChIKey | PESYEWKSBIWTAK-UHFFFAOYSA-N |
Product Overview
二茂钛 (CAS 1271-29-0), with molecular formula C10H10Ti and molecular weight 178.03 g/mol. IUPAC: bis(cyclopenta-1,3-diene);titanium(2+).
Chemical Property Profile of 二茂钛
Property Insights of 二茂钛
The XLogP value of 2.81 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 二茂钛. With a topological polar surface area (TPSA) of 0.0 Ų, 二茂钛 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 二茂钛 has 0 hydrogen bond donor(s) and 2 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 二茂钛?
The CAS number of 二茂钛 is 1271-29-0.
What is the molecular formula of 二茂钛?
The molecular formula of 二茂钛 is C10H10Ti.
What is the molecular weight of 二茂钛?
The molecular weight of 二茂钛 is 178.03 g/mol.
Where can I buy 二茂钛?
You can request a quote for 二茂钛 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二茂钛?
Yes, KEHONG BIO provides custom synthesis services for 二茂钛 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.