C14H16BrCl2NO5S
TL;DR: C14H16BrCl2NO5S (CAS 3785-28-2) is a chemical compound with molecular formula C14H16BrCl2NO5S and molecular weight 458.93097 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(2,2-dichloroacetyl)-[(4-methylsulfonylphenyl)methyl]amino]ethyl 2-bromoacetate
Also Known As: M & B 6163, Acetic acid, bromo-, 2-((dichloroacetyl)((4-(methylsulfonyl)phenyl)methyl)amino)ethyl ester, 2-[(2,2-dichloroacetyl)-[(4-methylsulfonylphenyl)methyl]amino]ethyl 2-bromoacetate, 2,2-Dichloro-N-(2-hydroxyethyl)-N-(p-(methylsulfonyl)benzyl)acetamide bromoacetate (ester), Acetic acid, 2-bromo-, 2-[(2,2-dichloroacetyl)[[4-(methylsulfonyl)phenyl]methyl]amino]ethyl ester
Technical Specifications
| Molecular Formula | C14H16BrCl2NO5S |
| Molecular Weight | 458.93097 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 89.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 458.93097 Da |
| Heavy Atoms | 24 |
| Complexity | 530.0 |
| SMILES | CS(=O)(=O)C1=CC=C(C=C1)CN(CCOC(=O)CBr)C(=O)C(Cl)Cl |
| InChIKey | NZOLBUNOTNPNKG-UHFFFAOYSA-N |
Product Description
Applications: C14H16BrCl2NO5S is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
C14H16BrCl2NO5S is a fine chemical identified by CAS number 3785-28-2 and the molecular formula C14H16BrCl2NO5S and a molecular weight of 458.93 g/mol. Synonyms include M & B 6163 and Acetic acid, bromo-, 2-((dichloroacetyl)((4-(methylsulfonyl)phenyl)methyl)amino)ethyl ester.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of C14H16BrCl2NO5S
Property Insights of C14H16BrCl2NO5S
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C14H16BrCl2NO5S. The TPSA of 89.1 Ų falls within the moderate polarity range, balancing permeability and solubility for C14H16BrCl2NO5S. Following Lipinski's Rule of Five, C14H16BrCl2NO5S has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of C14H16BrCl2NO5S?
The CAS number of C14H16BrCl2NO5S is 3785-28-2.
What is the molecular formula of C14H16BrCl2NO5S?
The molecular formula of C14H16BrCl2NO5S is C14H16BrCl2NO5S.
What is the molecular weight of C14H16BrCl2NO5S?
The molecular weight of C14H16BrCl2NO5S is 458.93097 g/mol.
What are the applications of C14H16BrCl2NO5S?
C14H16BrCl2NO5S is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Where can I buy C14H16BrCl2NO5S?
You can request a quote for C14H16BrCl2NO5S directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for C14H16BrCl2NO5S?
Yes, CoreyChem provides custom synthesis services for C14H16BrCl2NO5S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.