4-Chloronaphthalene-1,2-dione
TL;DR: 4-Chloronaphthalene-1,2-dione (CAS 67335-04-0) is a chemical compound with molecular formula C10H5ClO2 and molecular weight 192.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloronaphthalene-1,2-dione
Also Known As: 4-chloronaphthalene-1,2-dione, 4-Chloro-[1,2]naphthoquinone, 4-Chloro-1,2-naphthalenedione, 4-CHLORO-1,2-NAPHTHOQUINONE, 1,2-Naphthoquinone, 4-chloro-
| Molecular Formula | C10H5ClO2 |
|---|---|
| Molecular Weight | 192.00 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 191.9978 |
| Heavy Atoms | 13 |
| Complexity | 293.0 |
Chemical Identifiers
| CAS Number | 67335-04-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CC(=O)C2=O)Cl |
| InChIKey | MJUCWPGQCKMILF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Chloronaphthalene-1,2-dione (CAS 67335-04-0), with molecular formula C10H5ClO2 and molecular weight 192.00 g/mol. IUPAC: 4-chloronaphthalene-1,2-dione.
Chemical Property Profile of 4-Chloronaphthalene-1,2-dione
Property Insights of 4-Chloronaphthalene-1,2-dione
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Chloronaphthalene-1,2-dione. With a topological polar surface area (TPSA) of 34.1 Ų, 4-Chloronaphthalene-1,2-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloronaphthalene-1,2-dione 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 4-Chloronaphthalene-1,2-dione?
The CAS number of 4-Chloronaphthalene-1,2-dione is 67335-04-0.
What is the molecular formula of 4-Chloronaphthalene-1,2-dione?
The molecular formula of 4-Chloronaphthalene-1,2-dione is C10H5ClO2.
What is the molecular weight of 4-Chloronaphthalene-1,2-dione?
The molecular weight of 4-Chloronaphthalene-1,2-dione is 192.00 g/mol.
Where can I buy 4-Chloronaphthalene-1,2-dione?
You can request a quote for 4-Chloronaphthalene-1,2-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloronaphthalene-1,2-dione?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloronaphthalene-1,2-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.