Isotretinoin anisatil
TL;DR: Isotretinoin anisatil (CAS 65646-76-6) is a chemical compound with molecular formula C29H36O4 and molecular weight 448.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-methoxyphenyl)-2-oxoethyl] (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoate
Also Known As: Isotretinoin anisatil, EX-A13976T, Retinoic acid, 2-(4-methoxyphenyl)-2-oxoethyl ester, Retinoic acid,2-(4-methoxyphenyl)-2-oxoethyl ester, 13-cis, (2Z,4E,6E,8E)-2-(4-Methoxyphenyl)-2-oxoethyl 3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoate
| Molecular Formula | C29H36O4 |
|---|---|
| Molecular Weight | 448.26 g/mol |
| LogP | 6.9527 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 448.26135 |
| Heavy Atoms | 33 |
| Complexity | 998.5624 |
Chemical Identifiers
| CAS Number | 65646-76-6 |
|---|---|
| SMILES | CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C/C(=O)OCC(=O)C2=CC=C(C=C2)OC)/C)/C |
Product Overview
Isotretinoin anisatil (CAS 65646-76-6), with molecular formula C29H36O4 and molecular weight 448.26 g/mol. IUPAC: [2-(4-methoxyphenyl)-2-oxoethyl] (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoate.
Chemical Property Profile of Isotretinoin anisatil
Property Insights of Isotretinoin anisatil
The XLogP value of 6.9527 indicates that Isotretinoin anisatil is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Isotretinoin anisatil exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isotretinoin anisatil has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Isotretinoin anisatil?
The CAS number of Isotretinoin anisatil is 65646-76-6.
What is the molecular formula of Isotretinoin anisatil?
The molecular formula of Isotretinoin anisatil is C29H36O4.
What is the molecular weight of Isotretinoin anisatil?
The molecular weight of Isotretinoin anisatil is 448.26 g/mol.
Where can I buy Isotretinoin anisatil?
You can request a quote for Isotretinoin anisatil directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isotretinoin anisatil?
Yes, KEHONG BIO provides custom synthesis services for Isotretinoin anisatil and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.