2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecan-3-one, 1-chloromethyl-
TL;DR: 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecan-3-one, 1-chloromethyl- (CAS 81382-20-9) is a chemical compound with molecular formula C7H12ClNO4Si and molecular weight 237.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(chloromethyl)-2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecan-3-one
Also Known As: 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecan-3-one, 1-chloromethyl-, 5-(chloromethyl)-4,6,11-trioxa-1-aza-5-silabicyclo[3.3.3]undecan-3-one, 1-(chloromethyl)-2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecan-3-one, 2,8,9-Trioxa-5-aza-1-silabicyclo[3.3.3]undecan-3-one, 1-chloromethyl-
| Molecular Formula | C7H12ClNO4Si |
|---|---|
| Molecular Weight | 237.02 g/mol |
| LogP | -0.3911 |
| Topological Polar Surface Area | 48.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 237.02242 |
| Heavy Atoms | 14 |
| Complexity | 230.0 |
Chemical Identifiers
| CAS Number | 81382-20-9 |
|---|---|
| SMILES | C1CO[Si]2(OCCN1CC(=O)O2)CCl |
| InChIKey | YKVBLHUJBYGRLU-UHFFFAOYSA-N |
Product Overview
2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecan-3-one, 1-chloromethyl- (CAS 81382-20-9), with molecular formula C7H12ClNO4Si and molecular weight 237.02 g/mol. IUPAC: 1-(chloromethyl)-2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecan-3-one.
Chemical Property Profile of 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecan-3-one, 1-chloromethyl-
Property Insights of 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecan-3-one, 1-chloromethyl-
The XLogP value of -0.3911 indicates that 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecan-3-one, 1-chloromethyl- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 48.0 Ų, 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecan-3-one, 1-chloromethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecan-3-one, 1-chloromethyl- 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
Frequently Asked Questions
What is the CAS number of 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecan-3-one, 1-chloromethyl-?
The CAS number of 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecan-3-one, 1-chloromethyl- is 81382-20-9.
What is the molecular formula of 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecan-3-one, 1-chloromethyl-?
The molecular formula of 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecan-3-one, 1-chloromethyl- is C7H12ClNO4Si.
What is the molecular weight of 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecan-3-one, 1-chloromethyl-?
The molecular weight of 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecan-3-one, 1-chloromethyl- is 237.02 g/mol.
Where can I buy 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecan-3-one, 1-chloromethyl-?
You can request a quote for 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecan-3-one, 1-chloromethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecan-3-one, 1-chloromethyl-?
Yes, KEHONG BIO provides custom synthesis services for 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecan-3-one, 1-chloromethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.