Octadecyl 2-[4-hydroxy-3-methyl-5-(1-phenylethyl)phenyl]propanoate structure

Octadecyl 2-[4-hydroxy-3-methyl-5-(1-phenylethyl)phenyl]propanoate

TL;DR: Octadecyl 2-[4-hydroxy-3-methyl-5-(1-phenylethyl)phenyl]propanoate (CAS 75248-89-4) is a chemical compound with molecular formula C36H56O3 and molecular weight 536.42 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

octadecyl 2-[4-hydroxy-3-methyl-5-(1-phenylethyl)phenyl]propanoate

Also Known As: octadecyl 2-[4-hydroxy-3-methyl-5-(1-phenylethyl)phenyl]propanoate, Propanoic acid 2(or 3)-(4-hydroxy-3-methyl-5-(1-phenylethyl)phenyl)-, octadecyl ester

CAS: 75248-89-4
Molecular Formula C36H56O3
Molecular Weight 536.42 g/mol
LogP 10.76062
Topological Polar Surface Area 46.53 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 3
Rotatable Bonds 21
Exact Mass 536.423
Heavy Atoms 39
Complexity 920.3941

Chemical Identifiers

CAS Number 75248-89-4
SMILES CCCCCCCCCCCCCCCCCCOC(=O)C(C)C1=CC(=C(C(=C1)C)O)C(C)C2=CC=CC=C2

Product Overview

Octadecyl 2-[4-hydroxy-3-methyl-5-(1-phenylethyl)phenyl]propanoate (CAS 75248-89-4), with molecular formula C36H56O3 and molecular weight 536.42 g/mol. IUPAC: octadecyl 2-[4-hydroxy-3-methyl-5-(1-phenylethyl)phenyl]propanoate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of Octadecyl 2-[4-hydroxy-3-methyl-5-(1-phenylethyl)phenyl]propanoate

XLogP
10.76062
TPSA (Topological Polar Surface Area)
46.53
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
3
Rotatable Bonds
21
Heavy Atoms
39
Complexity
920.3941
Exact Mass
536.423
Monoisotopic Mass
536.423
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Octadecyl 2-[4-hydroxy-3-methyl-5-(1-phenylethyl)phenyl]propanoate

The XLogP value of 10.76062 indicates that Octadecyl 2-[4-hydroxy-3-methyl-5-(1-phenylethyl)phenyl]propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.53 Ų, Octadecyl 2-[4-hydroxy-3-methyl-5-(1-phenylethyl)phenyl]propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Octadecyl 2-[4-hydroxy-3-methyl-5-(1-phenylethyl)phenyl]propanoate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of Octadecyl 2-[4-hydroxy-3-methyl-5-(1-phenylethyl)phenyl]propanoate?

The CAS number of Octadecyl 2-[4-hydroxy-3-methyl-5-(1-phenylethyl)phenyl]propanoate is 75248-89-4.

What is the molecular formula of Octadecyl 2-[4-hydroxy-3-methyl-5-(1-phenylethyl)phenyl]propanoate?

The molecular formula of Octadecyl 2-[4-hydroxy-3-methyl-5-(1-phenylethyl)phenyl]propanoate is C36H56O3.

What is the molecular weight of Octadecyl 2-[4-hydroxy-3-methyl-5-(1-phenylethyl)phenyl]propanoate?

The molecular weight of Octadecyl 2-[4-hydroxy-3-methyl-5-(1-phenylethyl)phenyl]propanoate is 536.42 g/mol.

Where can I buy Octadecyl 2-[4-hydroxy-3-methyl-5-(1-phenylethyl)phenyl]propanoate?

You can request a quote for Octadecyl 2-[4-hydroxy-3-methyl-5-(1-phenylethyl)phenyl]propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for Octadecyl 2-[4-hydroxy-3-methyl-5-(1-phenylethyl)phenyl]propanoate?

Yes, KEHONG BIO provides custom synthesis services for Octadecyl 2-[4-hydroxy-3-methyl-5-(1-phenylethyl)phenyl]propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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