3-dodecyl-2,5-dihydroxy-1,4-benzoquinone, diammonium salt
TL;DR: 3-dodecyl-2,5-dihydroxy-1,4-benzoquinone, diammonium salt (CAS 5972-79-2) is a chemical compound with molecular formula C18H34N2O4 and molecular weight 342.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diazanium;2-dodecyl-3,6-dioxocyclohexa-1,4-diene-1,4-diolate
Also Known As: 3-Dodecyl-2,5-dihydroxy-1,4-benzoquinone, diammonium salt, diammonium 2-dodecyl-3,6-dioxocyclohexa-1,4-diene-1,4-diolate, p-Benzoquinone, 3-dodecyl-2,5-dihydroxy-, diammonium salt, diazanium 2-dodecyl-3,6-dioxocyclohexa-1,4-diene-1,4-diolate, diazanium,2-dodecyl-3,6-dioxocyclohexa-1,4-diene-1,4-diolate
| Molecular Formula | C18H34N2O4 |
|---|---|
| Molecular Weight | 342.25 g/mol |
| LogP | 3.06 |
| Topological Polar Surface Area | 82.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 342.25186 |
| Heavy Atoms | 24 |
| Complexity | 419.0 |
Chemical Identifiers
| CAS Number | 5972-79-2 |
|---|---|
| SMILES | CCCCCCCCCCCCC1=C(C(=O)C=C(C1=O)[O-])[O-].[NH4+].[NH4+] |
| InChIKey | JGKBGTUBKXFEBI-UHFFFAOYSA-N |
Product Overview
3-dodecyl-2,5-dihydroxy-1,4-benzoquinone, diammonium salt (CAS 5972-79-2), with molecular formula C18H34N2O4 and molecular weight 342.25 g/mol. IUPAC: diazanium;2-dodecyl-3,6-dioxocyclohexa-1,4-diene-1,4-diolate.
Chemical Property Profile of 3-dodecyl-2,5-dihydroxy-1,4-benzoquinone, diammonium salt
Property Insights of 3-dodecyl-2,5-dihydroxy-1,4-benzoquinone, diammonium salt
The XLogP value of 3.06 indicates that 3-dodecyl-2,5-dihydroxy-1,4-benzoquinone, diammonium salt is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-dodecyl-2,5-dihydroxy-1,4-benzoquinone, diammonium salt. Following Lipinski's Rule of Five, 3-dodecyl-2,5-dihydroxy-1,4-benzoquinone, diammonium salt has 2 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 3-dodecyl-2,5-dihydroxy-1,4-benzoquinone, diammonium salt?
The CAS number of 3-dodecyl-2,5-dihydroxy-1,4-benzoquinone, diammonium salt is 5972-79-2.
What is the molecular formula of 3-dodecyl-2,5-dihydroxy-1,4-benzoquinone, diammonium salt?
The molecular formula of 3-dodecyl-2,5-dihydroxy-1,4-benzoquinone, diammonium salt is C18H34N2O4.
What is the molecular weight of 3-dodecyl-2,5-dihydroxy-1,4-benzoquinone, diammonium salt?
The molecular weight of 3-dodecyl-2,5-dihydroxy-1,4-benzoquinone, diammonium salt is 342.25 g/mol.
Where can I buy 3-dodecyl-2,5-dihydroxy-1,4-benzoquinone, diammonium salt?
You can request a quote for 3-dodecyl-2,5-dihydroxy-1,4-benzoquinone, diammonium salt directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-dodecyl-2,5-dihydroxy-1,4-benzoquinone, diammonium salt?
Yes, KEHONG BIO provides custom synthesis services for 3-dodecyl-2,5-dihydroxy-1,4-benzoquinone, diammonium salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.