2-Chloro-3-(ethylamino)-1,4-naphthoquinone
TL;DR: 2-Chloro-3-(ethylamino)-1,4-naphthoquinone (CAS 59900-48-0) is a chemical compound with molecular formula C12H10ClNO2 and molecular weight 235.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-3-(ethylamino)naphthalene-1,4-dione
Also Known As: 2-chloro-3-(ethylamino)naphthalene-1,4-dione, 2-chloro-3-(ethylamino)naphthoquinone, 2-chloro-3-(ethylamino)-1,4-naphthoquinone, lactic acid-(1-methyl-heptyl ester), 2-chloro-3-ethylamino-1,4-naphthoquinone
| Molecular Formula | C12H10ClNO2 |
|---|---|
| Molecular Weight | 235.04 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 46.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 235.04001 |
| Heavy Atoms | 16 |
| Complexity | 362.0 |
Chemical Identifiers
| CAS Number | 59900-48-0 |
|---|---|
| SMILES | CCNC1=C(C(=O)C2=CC=CC=C2C1=O)Cl |
| InChIKey | XBADMYUFDWBDLJ-UHFFFAOYSA-N |
Product Overview
2-Chloro-3-(ethylamino)-1,4-naphthoquinone (CAS 59900-48-0), with molecular formula C12H10ClNO2 and molecular weight 235.04 g/mol. IUPAC: 2-chloro-3-(ethylamino)naphthalene-1,4-dione.
Chemical Property Profile of 2-Chloro-3-(ethylamino)-1,4-naphthoquinone
Property Insights of 2-Chloro-3-(ethylamino)-1,4-naphthoquinone
The XLogP value of 3.1 indicates that 2-Chloro-3-(ethylamino)-1,4-naphthoquinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.2 Ų, 2-Chloro-3-(ethylamino)-1,4-naphthoquinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-3-(ethylamino)-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 2-Chloro-3-(ethylamino)-1,4-naphthoquinone?
The CAS number of 2-Chloro-3-(ethylamino)-1,4-naphthoquinone is 59900-48-0.
What is the molecular formula of 2-Chloro-3-(ethylamino)-1,4-naphthoquinone?
The molecular formula of 2-Chloro-3-(ethylamino)-1,4-naphthoquinone is C12H10ClNO2.
What is the molecular weight of 2-Chloro-3-(ethylamino)-1,4-naphthoquinone?
The molecular weight of 2-Chloro-3-(ethylamino)-1,4-naphthoquinone is 235.04 g/mol.
Where can I buy 2-Chloro-3-(ethylamino)-1,4-naphthoquinone?
You can request a quote for 2-Chloro-3-(ethylamino)-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-Chloro-3-(ethylamino)-1,4-naphthoquinone?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-3-(ethylamino)-1,4-naphthoquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.