2-tert-Butylanthraquinone
TL;DR: 2-tert-Butylanthraquinone (CAS 84-47-9) is a chemical compound with molecular formula C18H16O2 and molecular weight 264.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-tert-butylanthracene-9,10-dione
Also Known As: 2-tert-Butylanthraquinone, 2-(tert-butyl)anthracene-9,10-dione, 2-tert-butylanthracene-9,10-dione, 2-t-butylanthraquinone, Anthraquinone, 2-tert-butyl-
| Molecular Formula | C18H16O2 |
|---|---|
| Molecular Weight | 264.12 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 264.11502 |
| Heavy Atoms | 20 |
| Complexity | 418.0 |
Chemical Identifiers
| CAS Number | 84-47-9 |
|---|---|
| SMILES | CC(C)(C)C1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O |
| InChIKey | YTPSFXZMJKMUJE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-tert-Butylanthraquinone (CAS 84-47-9), with molecular formula C18H16O2 and molecular weight 264.12 g/mol. IUPAC: 2-tert-butylanthracene-9,10-dione.
Chemical Property Profile of 2-tert-Butylanthraquinone
Property Insights of 2-tert-Butylanthraquinone
The XLogP value of 5.2 indicates that 2-tert-Butylanthraquinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.1 Ų, 2-tert-Butylanthraquinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-tert-Butylanthraquinone has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-tert-Butylanthraquinone?
The CAS number of 2-tert-Butylanthraquinone is 84-47-9.
What is the molecular formula of 2-tert-Butylanthraquinone?
The molecular formula of 2-tert-Butylanthraquinone is C18H16O2.
What is the molecular weight of 2-tert-Butylanthraquinone?
The molecular weight of 2-tert-Butylanthraquinone is 264.12 g/mol.
Where can I buy 2-tert-Butylanthraquinone?
You can request a quote for 2-tert-Butylanthraquinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-tert-Butylanthraquinone?
Yes, KEHONG BIO provides custom synthesis services for 2-tert-Butylanthraquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.