1,4-Naphthalenedione, 2-methyl-3-undecyl-
TL;DR: 1,4-Naphthalenedione, 2-methyl-3-undecyl- (CAS 18093-44-2) is a chemical compound with molecular formula C22H30O2 and molecular weight 326.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-3-undecylnaphthalene-1,4-dione
Also Known As: UHNQ, 1,4-Naphthalenedione, 2-methyl-3-undecyl-, 2-methyl-3-undecylnaphthalene-1,4-dione, 2-Methyl-3-undecyl-1,4-naphthoquinone, 3-undecyl-2-hydroxyl-1,4-naphthoquinone
| Molecular Formula | C22H30O2 |
|---|---|
| Molecular Weight | 326.22 g/mol |
| LogP | 7.0 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Exact Mass | 326.22458 |
| Heavy Atoms | 24 |
| Complexity | 461.0 |
Chemical Identifiers
| CAS Number | 18093-44-2 |
|---|---|
| SMILES | CCCCCCCCCCCC1=C(C(=O)C2=CC=CC=C2C1=O)C |
| InChIKey | ANINJZDEPNDTPH-UHFFFAOYSA-N |
Product Overview
1,4-Naphthalenedione, 2-methyl-3-undecyl- (CAS 18093-44-2), with molecular formula C22H30O2 and molecular weight 326.22 g/mol. IUPAC: 2-methyl-3-undecylnaphthalene-1,4-dione.
Chemical Property Profile of 1,4-Naphthalenedione, 2-methyl-3-undecyl-
Property Insights of 1,4-Naphthalenedione, 2-methyl-3-undecyl-
The XLogP value of 7.0 indicates that 1,4-Naphthalenedione, 2-methyl-3-undecyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.1 Ų, 1,4-Naphthalenedione, 2-methyl-3-undecyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Naphthalenedione, 2-methyl-3-undecyl- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,4-Naphthalenedione, 2-methyl-3-undecyl-?
The CAS number of 1,4-Naphthalenedione, 2-methyl-3-undecyl- is 18093-44-2.
What is the molecular formula of 1,4-Naphthalenedione, 2-methyl-3-undecyl-?
The molecular formula of 1,4-Naphthalenedione, 2-methyl-3-undecyl- is C22H30O2.
What is the molecular weight of 1,4-Naphthalenedione, 2-methyl-3-undecyl-?
The molecular weight of 1,4-Naphthalenedione, 2-methyl-3-undecyl- is 326.22 g/mol.
Where can I buy 1,4-Naphthalenedione, 2-methyl-3-undecyl-?
You can request a quote for 1,4-Naphthalenedione, 2-methyl-3-undecyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Naphthalenedione, 2-methyl-3-undecyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Naphthalenedione, 2-methyl-3-undecyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.