N,N-bis(2-chloroethyl)-4-hydroperoxy-3-methyl-2-oxo-1,3,2
TL;DR: N,N-bis(2-chloroethyl)-4-hydroperoxy-3-methyl-2-oxo-1,3,2 (CAS 39800-23-2) is a chemical compound with molecular formula C8H17Cl2N2O4P and molecular weight 306.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-bis(2-chloroethyl)-4-hydroperoxy-3-methyl-2-oxo-1,3,2λ5-oxazaphosphinan-2-amine
Also Known As: N,N-bis(2-chloroethyl)-4-hydroperoxy-3-methyl-2-oxo-1,3,2, 2-[Bis(2-chloroethyl)amino]-4-hydroperoxy-3-methyl-1,3,2lambda~5~-oxazaphosphinan-2-one, N,N-bis(2-chloroethyl)-4-hydroperoxy-3-methyl-2-oxo-1,3,2lambda5-, 2-[bis(2-chloroethyl)amino]-4-hydroperoxy-3-methyl-1,3,2-oxazaphosphinan-2-ium-2-olate, N,N-bis(2-chloroethyl)-4-hydroperoxy-3-methyl-2-oxo-1,3,2
| Molecular Formula | C8H17Cl2N2O4P |
|---|---|
| Molecular Weight | 306.03 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 62.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 306.0303 |
| Heavy Atoms | 17 |
| Complexity | 278.0 |
Chemical Identifiers
| CAS Number | 39800-23-2 |
|---|---|
| SMILES | CN1C(CCOP1(=O)N(CCCl)CCCl)OO |
| InChIKey | WFYRJCRAKJDMNE-UHFFFAOYSA-N |
Product Overview
N,N-bis(2-chloroethyl)-4-hydroperoxy-3-methyl-2-oxo-1,3,2 (CAS 39800-23-2), with molecular formula C8H17Cl2N2O4P and molecular weight 306.03 g/mol. IUPAC: N,N-bis(2-chloroethyl)-4-hydroperoxy-3-methyl-2-oxo-1,3,2λ5-oxazaphosphinan-2-amine.
Chemical Property Profile of N,N-bis(2-chloroethyl)-4-hydroperoxy-3-methyl-2-oxo-1,3,2
Property Insights of N,N-bis(2-chloroethyl)-4-hydroperoxy-3-methyl-2-oxo-1,3,2
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-bis(2-chloroethyl)-4-hydroperoxy-3-methyl-2-oxo-1,3,2. The TPSA of 62.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N-bis(2-chloroethyl)-4-hydroperoxy-3-methyl-2-oxo-1,3,2. Following Lipinski's Rule of Five, N,N-bis(2-chloroethyl)-4-hydroperoxy-3-methyl-2-oxo-1,3,2 has 1 hydrogen bond donor(s) and 6 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 N,N-bis(2-chloroethyl)-4-hydroperoxy-3-methyl-2-oxo-1,3,2?
The CAS number of N,N-bis(2-chloroethyl)-4-hydroperoxy-3-methyl-2-oxo-1,3,2 is 39800-23-2.
What is the molecular formula of N,N-bis(2-chloroethyl)-4-hydroperoxy-3-methyl-2-oxo-1,3,2?
The molecular formula of N,N-bis(2-chloroethyl)-4-hydroperoxy-3-methyl-2-oxo-1,3,2 is C8H17Cl2N2O4P.
What is the molecular weight of N,N-bis(2-chloroethyl)-4-hydroperoxy-3-methyl-2-oxo-1,3,2?
The molecular weight of N,N-bis(2-chloroethyl)-4-hydroperoxy-3-methyl-2-oxo-1,3,2 is 306.03 g/mol.
Where can I buy N,N-bis(2-chloroethyl)-4-hydroperoxy-3-methyl-2-oxo-1,3,2?
You can request a quote for N,N-bis(2-chloroethyl)-4-hydroperoxy-3-methyl-2-oxo-1,3,2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-bis(2-chloroethyl)-4-hydroperoxy-3-methyl-2-oxo-1,3,2?
Yes, KEHONG BIO provides custom synthesis services for N,N-bis(2-chloroethyl)-4-hydroperoxy-3-methyl-2-oxo-1,3,2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.