Phthalic acid, heptyl 2-naphthyl ester
TL;DR: Phthalic acid, heptyl 2-naphthyl ester (CAS 959073-98-4) is a chemical compound with molecular formula C25H26O4 and molecular weight 390.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-O-heptyl 2-O-naphthalen-2-yl benzene-1,2-dicarboxylate
Also Known As: Phthalic acid, heptyl 2-naphthyl ester, Heptyl naphthalen-2-yl benzene-1,2-dicarboxylate, 1-O-heptyl 2-O-naphthalen-2-yl benzene-1,2-dicarboxylate, 1,a2-aBenzenedicarboxylic acid, 1-aheptyl 2-a(2-anaphthalenyl) ester
| Molecular Formula | C25H26O4 |
|---|---|
| Molecular Weight | 390.18 g/mol |
| LogP | 6.1862 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 390.1831 |
| Heavy Atoms | 29 |
| Complexity | 977.2291 |
Chemical Identifiers
| CAS Number | 959073-98-4 |
|---|---|
| SMILES | CCCCCCCOC(=O)C1=CC=CC=C1C(=O)OC2=CC3=CC=CC=C3C=C2 |
Product Overview
Phthalic acid, heptyl 2-naphthyl ester (CAS 959073-98-4), with molecular formula C25H26O4 and molecular weight 390.18 g/mol. IUPAC: 1-O-heptyl 2-O-naphthalen-2-yl benzene-1,2-dicarboxylate.
Chemical Property Profile of Phthalic acid, heptyl 2-naphthyl ester
Property Insights of Phthalic acid, heptyl 2-naphthyl ester
The XLogP value of 6.1862 indicates that Phthalic acid, heptyl 2-naphthyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Phthalic acid, heptyl 2-naphthyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phthalic acid, heptyl 2-naphthyl ester 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 Phthalic acid, heptyl 2-naphthyl ester?
The CAS number of Phthalic acid, heptyl 2-naphthyl ester is 959073-98-4.
What is the molecular formula of Phthalic acid, heptyl 2-naphthyl ester?
The molecular formula of Phthalic acid, heptyl 2-naphthyl ester is C25H26O4.
What is the molecular weight of Phthalic acid, heptyl 2-naphthyl ester?
The molecular weight of Phthalic acid, heptyl 2-naphthyl ester is 390.18 g/mol.
Where can I buy Phthalic acid, heptyl 2-naphthyl ester?
You can request a quote for Phthalic acid, heptyl 2-naphthyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phthalic acid, heptyl 2-naphthyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phthalic acid, heptyl 2-naphthyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.