Dineopentyl phthalate
TL;DR: Dineopentyl phthalate (CAS 2553-24-4) is a chemical compound with molecular formula C18H26O4 and molecular weight 306.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2,2-dimethylpropyl) benzene-1,2-dicarboxylate
Also Known As: dineopentyl phthalate, Phthalic acid dineopentyl ester, Phthalic acid,dineopentyl ester, Phthalic acid, dineopentyl ester, Dineopentyl-1,2-benzenedicarboxylate
| Molecular Formula | C18H26O4 |
|---|---|
| Molecular Weight | 306.18 g/mol |
| LogP | 4.0924 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 306.1831 |
| Heavy Atoms | 22 |
| Complexity | 483.7535 |
Chemical Identifiers
| CAS Number | 2553-24-4 |
|---|---|
| SMILES | CC(C)(C)COC(=O)C1=CC=CC=C1C(=O)OCC(C)(C)C |
Product Overview
Dineopentyl phthalate (CAS 2553-24-4), with molecular formula C18H26O4 and molecular weight 306.18 g/mol. IUPAC: bis(2,2-dimethylpropyl) benzene-1,2-dicarboxylate.
Chemical Property Profile of Dineopentyl phthalate
Property Insights of Dineopentyl phthalate
The XLogP value of 4.0924 indicates that Dineopentyl phthalate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Dineopentyl phthalate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dineopentyl phthalate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dineopentyl phthalate?
The CAS number of Dineopentyl phthalate is 2553-24-4.
What is the molecular formula of Dineopentyl phthalate?
The molecular formula of Dineopentyl phthalate is C18H26O4.
What is the molecular weight of Dineopentyl phthalate?
The molecular weight of Dineopentyl phthalate is 306.18 g/mol.
Where can I buy Dineopentyl phthalate?
You can request a quote for Dineopentyl phthalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dineopentyl phthalate?
Yes, KEHONG BIO provides custom synthesis services for Dineopentyl phthalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.