(2,4,6-trichlorophenyl) N,N-bis(2-chloroethyl)carbamate
TL;DR: (2,4,6-trichlorophenyl) N,N-bis(2-chloroethyl)carbamate (CAS 10399-49-2) is a chemical compound with molecular formula C11H10Cl5NO2 and molecular weight 362.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,4,6-trichlorophenyl) N,N-bis(2-chloroethyl)carbamate
Also Known As: (2,4,6-trichlorophenyl) N,N-bis(2-chloroethyl)carbamate, 2,4,6-Trichlorophenyl bis(2-chloroethyl)carbamate, Carbamic acid,bis(2-chloroethyl)-, 2,4,6-trichlorophenyl ester (7ci,8ci,9ci)
| Molecular Formula | C11H10Cl5NO2 |
|---|---|
| Molecular Weight | 362.92 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 362.9154 |
| Heavy Atoms | 19 |
| Complexity | 276.0 |
Chemical Identifiers
| CAS Number | 10399-49-2 |
|---|---|
| SMILES | C1=C(C=C(C(=C1Cl)OC(=O)N(CCCl)CCCl)Cl)Cl |
| InChIKey | IFFHOYPOORKNQL-UHFFFAOYSA-N |
Product Overview
(2,4,6-trichlorophenyl) N,N-bis(2-chloroethyl)carbamate (CAS 10399-49-2), with molecular formula C11H10Cl5NO2 and molecular weight 362.92 g/mol. IUPAC: (2,4,6-trichlorophenyl) N,N-bis(2-chloroethyl)carbamate.
Chemical Property Profile of (2,4,6-trichlorophenyl) N,N-bis(2-chloroethyl)carbamate
Property Insights of (2,4,6-trichlorophenyl) N,N-bis(2-chloroethyl)carbamate
The XLogP value of 4.8 indicates that (2,4,6-trichlorophenyl) N,N-bis(2-chloroethyl)carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, (2,4,6-trichlorophenyl) N,N-bis(2-chloroethyl)carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2,4,6-trichlorophenyl) N,N-bis(2-chloroethyl)carbamate 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 (2,4,6-trichlorophenyl) N,N-bis(2-chloroethyl)carbamate?
The CAS number of (2,4,6-trichlorophenyl) N,N-bis(2-chloroethyl)carbamate is 10399-49-2.
What is the molecular formula of (2,4,6-trichlorophenyl) N,N-bis(2-chloroethyl)carbamate?
The molecular formula of (2,4,6-trichlorophenyl) N,N-bis(2-chloroethyl)carbamate is C11H10Cl5NO2.
What is the molecular weight of (2,4,6-trichlorophenyl) N,N-bis(2-chloroethyl)carbamate?
The molecular weight of (2,4,6-trichlorophenyl) N,N-bis(2-chloroethyl)carbamate is 362.92 g/mol.
Where can I buy (2,4,6-trichlorophenyl) N,N-bis(2-chloroethyl)carbamate?
You can request a quote for (2,4,6-trichlorophenyl) N,N-bis(2-chloroethyl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2,4,6-trichlorophenyl) N,N-bis(2-chloroethyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for (2,4,6-trichlorophenyl) N,N-bis(2-chloroethyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.