p-Benzoquinone, 5-(di-2'-chloroethylamino)-2-methoxy-
TL;DR: p-Benzoquinone, 5-(di-2'-chloroethylamino)-2-methoxy- (CAS 64048-63-1) is a chemical compound with molecular formula C11H13Cl2NO3 and molecular weight 277.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[bis(2-chloroethyl)amino]-5-methoxycyclohexa-2,5-diene-1,4-dione
Also Known As: 3-Aminophenyltrimethylammonium iodide, p-Benzoquinone, 5-(di-2'-chloroethylamino)-2-methoxy-, 2-[bis(2-chloroethyl)amino]-5-methoxycyclohexa-2,5-diene-1,4-dione, 2-Methoxy-5-(di-2'-chloroethylamino)-1,4-benzoquinone, 5-[Bis amino]-2-methoxy-1,4-benzoquinone
| Molecular Formula | C11H13Cl2NO3 |
|---|---|
| Molecular Weight | 277.03 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 46.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 277.02725 |
| Heavy Atoms | 17 |
| Complexity | 371.0 |
Chemical Identifiers
| CAS Number | 64048-63-1 |
|---|---|
| SMILES | COC1=CC(=O)C(=CC1=O)N(CCCl)CCCl |
| InChIKey | ABDORDNSDLKMOD-UHFFFAOYSA-N |
Product Overview
p-Benzoquinone, 5-(di-2'-chloroethylamino)-2-methoxy- (CAS 64048-63-1), with molecular formula C11H13Cl2NO3 and molecular weight 277.03 g/mol. IUPAC: 2-[bis(2-chloroethyl)amino]-5-methoxycyclohexa-2,5-diene-1,4-dione.
Chemical Property Profile of p-Benzoquinone, 5-(di-2'-chloroethylamino)-2-methoxy-
Property Insights of p-Benzoquinone, 5-(di-2'-chloroethylamino)-2-methoxy-
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for p-Benzoquinone, 5-(di-2'-chloroethylamino)-2-methoxy-. With a topological polar surface area (TPSA) of 46.6 Ų, p-Benzoquinone, 5-(di-2'-chloroethylamino)-2-methoxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, p-Benzoquinone, 5-(di-2'-chloroethylamino)-2-methoxy- has 0 hydrogen bond donor(s) and 4 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 p-Benzoquinone, 5-(di-2'-chloroethylamino)-2-methoxy-?
The CAS number of p-Benzoquinone, 5-(di-2'-chloroethylamino)-2-methoxy- is 64048-63-1.
What is the molecular formula of p-Benzoquinone, 5-(di-2'-chloroethylamino)-2-methoxy-?
The molecular formula of p-Benzoquinone, 5-(di-2'-chloroethylamino)-2-methoxy- is C11H13Cl2NO3.
What is the molecular weight of p-Benzoquinone, 5-(di-2'-chloroethylamino)-2-methoxy-?
The molecular weight of p-Benzoquinone, 5-(di-2'-chloroethylamino)-2-methoxy- is 277.03 g/mol.
Where can I buy p-Benzoquinone, 5-(di-2'-chloroethylamino)-2-methoxy-?
You can request a quote for p-Benzoquinone, 5-(di-2'-chloroethylamino)-2-methoxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for p-Benzoquinone, 5-(di-2'-chloroethylamino)-2-methoxy-?
Yes, KEHONG BIO provides custom synthesis services for p-Benzoquinone, 5-(di-2'-chloroethylamino)-2-methoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.