2,6-Dimethyl-1,4-naphthoquinone
TL;DR: 2,6-Dimethyl-1,4-naphthoquinone (CAS 6952-64-3) is a chemical compound with molecular formula C12H10O2 and molecular weight 186.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-dimethylnaphthalene-1,4-dione
Also Known As: 2,6-dimethylnaphthalene-1,4-dione, 2,6-dimethyl-1,4-naphthoquinone, 2,6-dimethylnaphthaquinone, 1,4-Naphthalenedione, 2,6-dimethyl-, 6-methyl-2-methylnaphthalene-1,4-dione
| Molecular Formula | C12H10O2 |
|---|---|
| Molecular Weight | 186.07 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 186.06808 |
| Heavy Atoms | 14 |
| Complexity | 314.0 |
Chemical Identifiers
| CAS Number | 6952-64-3 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)C(=O)C(=CC2=O)C |
| InChIKey | SRLBDWAAORRXIC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,6-Dimethyl-1,4-naphthoquinone (CAS 6952-64-3), with molecular formula C12H10O2 and molecular weight 186.07 g/mol. IUPAC: 2,6-dimethylnaphthalene-1,4-dione.
Chemical Property Profile of 2,6-Dimethyl-1,4-naphthoquinone
Property Insights of 2,6-Dimethyl-1,4-naphthoquinone
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6-Dimethyl-1,4-naphthoquinone. With a topological polar surface area (TPSA) of 34.1 Ų, 2,6-Dimethyl-1,4-naphthoquinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Dimethyl-1,4-naphthoquinone has 0 hydrogen bond donor(s) and 2 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 2,6-Dimethyl-1,4-naphthoquinone?
The CAS number of 2,6-Dimethyl-1,4-naphthoquinone is 6952-64-3.
What is the molecular formula of 2,6-Dimethyl-1,4-naphthoquinone?
The molecular formula of 2,6-Dimethyl-1,4-naphthoquinone is C12H10O2.
What is the molecular weight of 2,6-Dimethyl-1,4-naphthoquinone?
The molecular weight of 2,6-Dimethyl-1,4-naphthoquinone is 186.07 g/mol.
Where can I buy 2,6-Dimethyl-1,4-naphthoquinone?
You can request a quote for 2,6-Dimethyl-1,4-naphthoquinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Dimethyl-1,4-naphthoquinone?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Dimethyl-1,4-naphthoquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.