Heptanoic acid;6-methylheptanoic acid;nonanoic acid;phthalic acid
TL;DR: Heptanoic acid;6-methylheptanoic acid;nonanoic acid;phthalic acid (CAS 70955-55-4) is a chemical compound with molecular formula C32H54O10 and molecular weight 598.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
heptanoic acid;6-methylheptanoic acid;nonanoic acid;phthalic acid
Also Known As: 1,2-Benzenedicarboxylic acid, mixed heptyl and isooctyl and nonyl diesters, heptanoic acid; 6-methylheptanoic acid; nonanoic acid; phthalic acid
| Molecular Formula | C32H54O10 |
|---|---|
| Molecular Weight | 598.37 g/mol |
| LogP | 8.23 |
| Topological Polar Surface Area | 187.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 19 |
| Exact Mass | 598.3717 |
| Heavy Atoms | 42 |
| Complexity | 453.0 |
Chemical Identifiers
| CAS Number | 70955-55-4 |
|---|---|
| SMILES | CCCCCCCCC(=O)O.CCCCCCC(=O)O.CC(C)CCCCC(=O)O.C1=CC=C(C(=C1)C(=O)O)C(=O)O |
| InChIKey | LSKFFABOVHLRKF-UHFFFAOYSA-N |
Product Overview
Heptanoic acid;6-methylheptanoic acid;nonanoic acid;phthalic acid (CAS 70955-55-4), with molecular formula C32H54O10 and molecular weight 598.37 g/mol. IUPAC: heptanoic acid;6-methylheptanoic acid;nonanoic acid;phthalic acid.
Chemical Property Profile of Heptanoic acid;6-methylheptanoic acid;nonanoic acid;phthalic acid
Property Insights of Heptanoic acid;6-methylheptanoic acid;nonanoic acid;phthalic acid
The XLogP value of 8.23 indicates that Heptanoic acid;6-methylheptanoic acid;nonanoic acid;phthalic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 187.0 Ų indicates high polarity, suggesting Heptanoic acid;6-methylheptanoic acid;nonanoic acid;phthalic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Heptanoic acid;6-methylheptanoic acid;nonanoic acid;phthalic acid has 5 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Heptanoic acid;6-methylheptanoic acid;nonanoic acid;phthalic acid?
The CAS number of Heptanoic acid;6-methylheptanoic acid;nonanoic acid;phthalic acid is 70955-55-4.
What is the molecular formula of Heptanoic acid;6-methylheptanoic acid;nonanoic acid;phthalic acid?
The molecular formula of Heptanoic acid;6-methylheptanoic acid;nonanoic acid;phthalic acid is C32H54O10.
What is the molecular weight of Heptanoic acid;6-methylheptanoic acid;nonanoic acid;phthalic acid?
The molecular weight of Heptanoic acid;6-methylheptanoic acid;nonanoic acid;phthalic acid is 598.37 g/mol.
Where can I buy Heptanoic acid;6-methylheptanoic acid;nonanoic acid;phthalic acid?
You can request a quote for Heptanoic acid;6-methylheptanoic acid;nonanoic acid;phthalic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Heptanoic acid;6-methylheptanoic acid;nonanoic acid;phthalic acid?
Yes, KEHONG BIO provides custom synthesis services for Heptanoic acid;6-methylheptanoic acid;nonanoic acid;phthalic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.