5,5-dimethyl-2-[(E)-1-phenylhept-1-en-2-yl]-1,3-dioxane structure

5,5-dimethyl-2-[(E)-1-phenylhept-1-en-2-yl]-1,3-dioxane

TL;DR: 5,5-dimethyl-2-[(E)-1-phenylhept-1-en-2-yl]-1,3-dioxane (CAS 813-90-1) is a chemical compound with molecular formula C19H28O2 and molecular weight 288.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

5,5-dimethyl-2-[(E)-1-phenylhept-1-en-2-yl]-1,3-dioxane

Also Known As: 5,5-dimethyl-2-(1-phenylhept-1-en-2-yl)-1,3-dioxane, 5,5-dimethyl-2-[(E)-1-phenylhept-1-en-2-yl]-1,3-dioxane

CAS: 813-90-1
Molecular Formula C19H28O2
Molecular Weight 288.21 g/mol
LogP 5.0494
Topological Polar Surface Area 18.46 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 2
Rotatable Bonds 6
Exact Mass 288.20892
Heavy Atoms 21
Complexity 437.89398

Chemical Identifiers

CAS Number 813-90-1
SMILES CCCCC/C(=C\C1=CC=CC=C1)/C2OCC(CO2)(C)C

Product Overview

5,5-dimethyl-2-[(E)-1-phenylhept-1-en-2-yl]-1,3-dioxane (CAS 813-90-1), with molecular formula C19H28O2 and molecular weight 288.21 g/mol. IUPAC: 5,5-dimethyl-2-[(E)-1-phenylhept-1-en-2-yl]-1,3-dioxane.

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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 5,5-dimethyl-2-[(E)-1-phenylhept-1-en-2-yl]-1,3-dioxane

XLogP
5.0494
TPSA (Topological Polar Surface Area)
18.46
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
Rotatable Bonds
6
Heavy Atoms
21
Complexity
437.89398
Exact Mass
288.20892
Monoisotopic Mass
288.20892
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 5,5-dimethyl-2-[(E)-1-phenylhept-1-en-2-yl]-1,3-dioxane

The XLogP value of 5.0494 indicates that 5,5-dimethyl-2-[(E)-1-phenylhept-1-en-2-yl]-1,3-dioxane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.46 Ų, 5,5-dimethyl-2-[(E)-1-phenylhept-1-en-2-yl]-1,3-dioxane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,5-dimethyl-2-[(E)-1-phenylhept-1-en-2-yl]-1,3-dioxane has 0 hydrogen bond donor(s) and 2 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 5,5-dimethyl-2-[(E)-1-phenylhept-1-en-2-yl]-1,3-dioxane?

The CAS number of 5,5-dimethyl-2-[(E)-1-phenylhept-1-en-2-yl]-1,3-dioxane is 813-90-1.

What is the molecular formula of 5,5-dimethyl-2-[(E)-1-phenylhept-1-en-2-yl]-1,3-dioxane?

The molecular formula of 5,5-dimethyl-2-[(E)-1-phenylhept-1-en-2-yl]-1,3-dioxane is C19H28O2.

What is the molecular weight of 5,5-dimethyl-2-[(E)-1-phenylhept-1-en-2-yl]-1,3-dioxane?

The molecular weight of 5,5-dimethyl-2-[(E)-1-phenylhept-1-en-2-yl]-1,3-dioxane is 288.21 g/mol.

Where can I buy 5,5-dimethyl-2-[(E)-1-phenylhept-1-en-2-yl]-1,3-dioxane?

You can request a quote for 5,5-dimethyl-2-[(E)-1-phenylhept-1-en-2-yl]-1,3-dioxane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for 5,5-dimethyl-2-[(E)-1-phenylhept-1-en-2-yl]-1,3-dioxane?

Yes, KEHONG BIO provides custom synthesis services for 5,5-dimethyl-2-[(E)-1-phenylhept-1-en-2-yl]-1,3-dioxane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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