Aniten
TL;DR: Aniten (CAS 53568-85-7) is a chemical compound with molecular formula C35H43ClO6 and molecular weight 594.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Aniten
butyl 9-hydroxyfluorene-9-carboxylate;6-methylheptyl 2-(4-chloro-2-methylphenoxy)acetate
Also Known As: ANITEN, 9H-Fluorene-9-carboxylic acid, 9-hydroxy-, butyl ester, mixt. with isooctyl (4-chloro-2-methylphenoxy)acetate, Butyl 9-hydroxy-9H-fluorene-9-carboxylate mixt. with isooctyl (4-chloro-2-methylphenoxy)acetate, butyl 9-hydroxyfluorene-9-carboxylate; 6-methylheptyl 2-(4-chloro-2-methylphenoxy)acetate, Butyl 9-hydroxy-9H-fluorene-9-carboxylate--6-methylheptyl (4-chloro-2-methylphenoxy)acetate (1/1)
| Molecular Formula | C35H43ClO6 |
|---|---|
| Molecular Weight | 594.27 g/mol |
| LogP | 8.03 |
| Topological Polar Surface Area | 82.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 15 |
| Exact Mass | 594.27484 |
| Heavy Atoms | 42 |
| Complexity | 650.0 |
Chemical Identifiers
| CAS Number | 53568-85-7 |
|---|---|
| SMILES | CCCCOC(=O)C1(C2=CC=CC=C2C3=CC=CC=C31)O.CC1=C(C=CC(=C1)Cl)OCC(=O)OCCCCCC(C)C |
| InChIKey | LRBPKXWKNRGSTG-UHFFFAOYSA-N |
Product Overview
Aniten (CAS 53568-85-7), with molecular formula C35H43ClO6 and molecular weight 594.27 g/mol. IUPAC: butyl 9-hydroxyfluorene-9-carboxylate;6-methylheptyl 2-(4-chloro-2-methylphenoxy)acetate.
Chemical Property Profile of Aniten
Property Insights of Aniten
The XLogP value of 8.03 indicates that Aniten is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Aniten. Following Lipinski's Rule of Five, Aniten has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Aniten?
The CAS number of Aniten is 53568-85-7.
What is the molecular formula of Aniten?
The molecular formula of Aniten is C35H43ClO6.
What is the molecular weight of Aniten?
The molecular weight of Aniten is 594.27 g/mol.
Where can I buy Aniten?
You can request a quote for Aniten directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aniten?
Yes, KEHONG BIO provides custom synthesis services for Aniten and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.