m-Dioxane, 2-(p-bis(2-(chloroethyl)amino)phenyl)-
TL;DR: m-Dioxane, 2-(p-bis(2-(chloroethyl)amino)phenyl)- (CAS 10549-94-7) is a chemical compound with molecular formula C14H19Cl2NO2 and molecular weight 303.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-bis(2-chloroethyl)-4-(1,3-dioxan-2-yl)aniline
Also Known As: m-DIOXANE, 2-(p-BIS(2-(CHLOROETHYL)AMINO)PHENYL)-, N,N-bis(2-chloroethyl)-4-(1,3-dioxan-2-yl)aniline, 2-(p-Bis(2-(chloroethyl)amino)phenyl)-m-dioxane, 5-19-08-00412 (Beilstein Handbook Reference), Benzaldehyde nitrogen mustard trimethylene glycol acetal
| Molecular Formula | C14H19Cl2NO2 |
|---|---|
| Molecular Weight | 303.08 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 21.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 303.07928 |
| Heavy Atoms | 19 |
| Complexity | 236.0 |
Chemical Identifiers
| CAS Number | 10549-94-7 |
|---|---|
| SMILES | C1COC(OC1)C2=CC=C(C=C2)N(CCCl)CCCl |
| InChIKey | ZDLSLAQPFGCCKH-UHFFFAOYSA-N |
Product Overview
m-Dioxane, 2-(p-bis(2-(chloroethyl)amino)phenyl)- (CAS 10549-94-7), with molecular formula C14H19Cl2NO2 and molecular weight 303.08 g/mol. IUPAC: N,N-bis(2-chloroethyl)-4-(1,3-dioxan-2-yl)aniline.
Chemical Property Profile of m-Dioxane, 2-(p-bis(2-(chloroethyl)amino)phenyl)-
Property Insights of m-Dioxane, 2-(p-bis(2-(chloroethyl)amino)phenyl)-
The XLogP value of 3.0 indicates that m-Dioxane, 2-(p-bis(2-(chloroethyl)amino)phenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.7 Ų, m-Dioxane, 2-(p-bis(2-(chloroethyl)amino)phenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, m-Dioxane, 2-(p-bis(2-(chloroethyl)amino)phenyl)- has 0 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 m-Dioxane, 2-(p-bis(2-(chloroethyl)amino)phenyl)-?
The CAS number of m-Dioxane, 2-(p-bis(2-(chloroethyl)amino)phenyl)- is 10549-94-7.
What is the molecular formula of m-Dioxane, 2-(p-bis(2-(chloroethyl)amino)phenyl)-?
The molecular formula of m-Dioxane, 2-(p-bis(2-(chloroethyl)amino)phenyl)- is C14H19Cl2NO2.
What is the molecular weight of m-Dioxane, 2-(p-bis(2-(chloroethyl)amino)phenyl)-?
The molecular weight of m-Dioxane, 2-(p-bis(2-(chloroethyl)amino)phenyl)- is 303.08 g/mol.
Where can I buy m-Dioxane, 2-(p-bis(2-(chloroethyl)amino)phenyl)-?
You can request a quote for m-Dioxane, 2-(p-bis(2-(chloroethyl)amino)phenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for m-Dioxane, 2-(p-bis(2-(chloroethyl)amino)phenyl)-?
Yes, KEHONG BIO provides custom synthesis services for m-Dioxane, 2-(p-bis(2-(chloroethyl)amino)phenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.