4-(Acetylamino)phenylretinoate
TL;DR: 4-(Acetylamino)phenylretinoate (CAS 103810-85-1) is a chemical compound with molecular formula C28H35NO3 and molecular weight 433.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-acetamidophenyl) (2Z,4E,6Z,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoate
Also Known As: 4-(Acetylamino)phenylretinoate, 4-acetamidophenyl retinoate, Bmy 30123, Retinoic acid, 4-(acetylamino)phenyl ester, Retinoic acid 4-acetamidophenyl ester
| Molecular Formula | C28H35NO3 |
|---|---|
| Molecular Weight | 433.26 g/mol |
| LogP | 7.082 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 433.2617 |
| Heavy Atoms | 32 |
| Complexity | 986.0087 |
Chemical Identifiers
| CAS Number | 103810-85-1 |
|---|---|
| SMILES | CC1=C(C(CCC1)(C)C)/C=C/C(=C\C=C\C(=C/C(=O)OC2=CC=C(C=C2)NC(=O)C)\C)/C |
Product Overview
4-(Acetylamino)phenylretinoate (CAS 103810-85-1), with molecular formula C28H35NO3 and molecular weight 433.26 g/mol. IUPAC: (4-acetamidophenyl) (2Z,4E,6Z,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoate.
Chemical Property Profile of 4-(Acetylamino)phenylretinoate
Property Insights of 4-(Acetylamino)phenylretinoate
The XLogP value of 7.082 indicates that 4-(Acetylamino)phenylretinoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, 4-(Acetylamino)phenylretinoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Acetylamino)phenylretinoate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(Acetylamino)phenylretinoate?
The CAS number of 4-(Acetylamino)phenylretinoate is 103810-85-1.
What is the molecular formula of 4-(Acetylamino)phenylretinoate?
The molecular formula of 4-(Acetylamino)phenylretinoate is C28H35NO3.
What is the molecular weight of 4-(Acetylamino)phenylretinoate?
The molecular weight of 4-(Acetylamino)phenylretinoate is 433.26 g/mol.
Where can I buy 4-(Acetylamino)phenylretinoate?
You can request a quote for 4-(Acetylamino)phenylretinoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Acetylamino)phenylretinoate?
Yes, KEHONG BIO provides custom synthesis services for 4-(Acetylamino)phenylretinoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.