4,4-双(2-氯乙基)吗啉鎓氯化物
TL;DR: 4,4-双(2-氯乙基)吗啉鎓氯化物 (CAS 64039-02-7) is a chemical compound with molecular formula C8H16Cl3NO and molecular weight 247.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4-双(2-氯乙基)吗啉鎓氯化物
4,4-bis(2-chloroethyl)morpholin-4-ium chloride
Also Known As: Bis(beta-chloroethyl)morpholinium chloride, 4,4-bis(2-chloroethyl)morpholin-4-ium chloride, Morpholinium, bis(2-chloroethyl)-, chloride, 3-(dimethylamino)-4-methylbenzenesulfonamide, RefChem:1069319
| Molecular Formula | C8H16Cl3NO |
|---|---|
| Molecular Weight | 247.03 g/mol |
| LogP | -1.68 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 247.02974 |
| Heavy Atoms | 13 |
| Complexity | 118.0 |
Chemical Identifiers
| CAS Number | 64039-02-7 |
|---|---|
| SMILES | C1COCC[N+]1(CCCl)CCCl.[Cl-] |
| InChIKey | ITHNRVXVNFCZSJ-UHFFFAOYSA-M |
Product Overview
4,4-双(2-氯乙基)吗啉鎓氯化物 (CAS 64039-02-7), with molecular formula C8H16Cl3NO and molecular weight 247.03 g/mol. IUPAC: 4,4-bis(2-chloroethyl)morpholin-4-ium chloride.
Chemical Property Profile of 4,4-双(2-氯乙基)吗啉鎓氯化物
Property Insights of 4,4-双(2-氯乙基)吗啉鎓氯化物
The XLogP value of -1.68 indicates that 4,4-双(2-氯乙基)吗啉鎓氯化物 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 9.2 Ų, 4,4-双(2-氯乙基)吗啉鎓氯化物 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4-双(2-氯乙基)吗啉鎓氯化物 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 4,4-双(2-氯乙基)吗啉鎓氯化物?
The CAS number of 4,4-双(2-氯乙基)吗啉鎓氯化物 is 64039-02-7.
What is the molecular formula of 4,4-双(2-氯乙基)吗啉鎓氯化物?
The molecular formula of 4,4-双(2-氯乙基)吗啉鎓氯化物 is C8H16Cl3NO.
What is the molecular weight of 4,4-双(2-氯乙基)吗啉鎓氯化物?
The molecular weight of 4,4-双(2-氯乙基)吗啉鎓氯化物 is 247.03 g/mol.
Where can I buy 4,4-双(2-氯乙基)吗啉鎓氯化物?
You can request a quote for 4,4-双(2-氯乙基)吗啉鎓氯化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4-双(2-氯乙基)吗啉鎓氯化物?
Yes, KEHONG BIO provides custom synthesis services for 4,4-双(2-氯乙基)吗啉鎓氯化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.