Q 26 2-(3-Chloro-3-methylbutyl)-3-hydroxy-1,4-naphthoquinone
TL;DR: Q 26 2-(3-Chloro-3-methylbutyl)-3-hydroxy-1,4-naphthoquinone (CAS 111479-51-7) is a chemical compound with molecular formula C15H15ClO3 and molecular weight 278.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-chloro-3-methylbutyl)-4-hydroxynaphthalene-1,2-dione
Also Known As: 3-(3-chloro-3-methylbutyl)-4-hydroxynaphthalene-1,2-dione, J1.561.912K, 1,4-Naphthalenedione, 2-(3-chloro-3-methylbutyl)-3-hydroxy-, Q 26 2-(3-CHLORO-3-METHYLBUTYL)-3-HYDROXY-1,4-NAPHTHOQUINONE, 2-(3-Chloro-3-methylbutyl)-3-hydroxy-1,4-naphthoquinone
| Molecular Formula | C15H15ClO3 |
|---|---|
| Molecular Weight | 278.07 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 278.07098 |
| Heavy Atoms | 19 |
| Complexity | 437.0 |
Chemical Identifiers
| CAS Number | 111479-51-7 |
|---|---|
| SMILES | CC(C)(CCC1=C(C2=CC=CC=C2C(=O)C1=O)O)Cl |
| InChIKey | XGXUKHSGLDPMRK-UHFFFAOYSA-N |
Product Overview
Q 26 2-(3-Chloro-3-methylbutyl)-3-hydroxy-1,4-naphthoquinone (CAS 111479-51-7), with molecular formula C15H15ClO3 and molecular weight 278.07 g/mol. IUPAC: 3-(3-chloro-3-methylbutyl)-4-hydroxynaphthalene-1,2-dione.
Chemical Property Profile of Q 26 2-(3-Chloro-3-methylbutyl)-3-hydroxy-1,4-naphthoquinone
Property Insights of Q 26 2-(3-Chloro-3-methylbutyl)-3-hydroxy-1,4-naphthoquinone
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Q 26 2-(3-Chloro-3-methylbutyl)-3-hydroxy-1,4-naphthoquinone. With a topological polar surface area (TPSA) of 54.4 Ų, Q 26 2-(3-Chloro-3-methylbutyl)-3-hydroxy-1,4-naphthoquinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Q 26 2-(3-Chloro-3-methylbutyl)-3-hydroxy-1,4-naphthoquinone has 1 hydrogen bond donor(s) and 3 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 Q 26 2-(3-Chloro-3-methylbutyl)-3-hydroxy-1,4-naphthoquinone?
The CAS number of Q 26 2-(3-Chloro-3-methylbutyl)-3-hydroxy-1,4-naphthoquinone is 111479-51-7.
What is the molecular formula of Q 26 2-(3-Chloro-3-methylbutyl)-3-hydroxy-1,4-naphthoquinone?
The molecular formula of Q 26 2-(3-Chloro-3-methylbutyl)-3-hydroxy-1,4-naphthoquinone is C15H15ClO3.
What is the molecular weight of Q 26 2-(3-Chloro-3-methylbutyl)-3-hydroxy-1,4-naphthoquinone?
The molecular weight of Q 26 2-(3-Chloro-3-methylbutyl)-3-hydroxy-1,4-naphthoquinone is 278.07 g/mol.
Where can I buy Q 26 2-(3-Chloro-3-methylbutyl)-3-hydroxy-1,4-naphthoquinone?
You can request a quote for Q 26 2-(3-Chloro-3-methylbutyl)-3-hydroxy-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 Q 26 2-(3-Chloro-3-methylbutyl)-3-hydroxy-1,4-naphthoquinone?
Yes, KEHONG BIO provides custom synthesis services for Q 26 2-(3-Chloro-3-methylbutyl)-3-hydroxy-1,4-naphthoquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.