Hexanedioic acid, 1,6-dianhydride with acetic acid
TL;DR: Hexanedioic acid, 1,6-dianhydride with acetic acid (CAS 4889-63-8) is a chemical compound with molecular formula C10H14O6 and molecular weight 230.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diacetyl hexanedioate
Also Known As: diacetyl adipate, diacetyl hexanedioate, Adipic acetic dianhydride, Hexanedioic acid, dianhydride with acetic acid, Hexanedioic acid diacetyl ester
| Molecular Formula | C10H14O6 |
|---|---|
| Molecular Weight | 230.08 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 86.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 230.07904 |
| Heavy Atoms | 16 |
| Complexity | 264.0 |
Chemical Identifiers
| CAS Number | 4889-63-8 |
|---|---|
| SMILES | CC(=O)OC(=O)CCCCC(=O)OC(=O)C |
| InChIKey | RFANYEWAHJJLAD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Hexanedioic acid, 1,6-dianhydride with acetic acid (CAS 4889-63-8), with molecular formula C10H14O6 and molecular weight 230.08 g/mol. IUPAC: diacetyl hexanedioate.
Chemical Property Profile of Hexanedioic acid, 1,6-dianhydride with acetic acid
Property Insights of Hexanedioic acid, 1,6-dianhydride with acetic acid
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hexanedioic acid, 1,6-dianhydride with acetic acid. The TPSA of 86.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Hexanedioic acid, 1,6-dianhydride with acetic acid. Following Lipinski's Rule of Five, Hexanedioic acid, 1,6-dianhydride with acetic acid has 0 hydrogen bond donor(s) and 6 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 Hexanedioic acid, 1,6-dianhydride with acetic acid?
The CAS number of Hexanedioic acid, 1,6-dianhydride with acetic acid is 4889-63-8.
What is the molecular formula of Hexanedioic acid, 1,6-dianhydride with acetic acid?
The molecular formula of Hexanedioic acid, 1,6-dianhydride with acetic acid is C10H14O6.
What is the molecular weight of Hexanedioic acid, 1,6-dianhydride with acetic acid?
The molecular weight of Hexanedioic acid, 1,6-dianhydride with acetic acid is 230.08 g/mol.
Where can I buy Hexanedioic acid, 1,6-dianhydride with acetic acid?
You can request a quote for Hexanedioic acid, 1,6-dianhydride with acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexanedioic acid, 1,6-dianhydride with acetic acid?
Yes, KEHONG BIO provides custom synthesis services for Hexanedioic acid, 1,6-dianhydride with acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.