1,3,6-Triaza-phosphatricyclo(4.3.1.13,8)undecane, 8-oxide
TL;DR: 1,3,6-Triaza-phosphatricyclo(4.3.1.13,8)undecane, 8-oxide (CAS 56971-17-6) is a chemical compound with molecular formula C7H14N3OP and molecular weight 187.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,6-triaza-8λ5-phosphatricyclo[4.3.1.13,8]undecane 8-oxide
Also Known As: 1,3,6-Triaza-phosphatricyclo(4.3.1.13,8)undecane, 8-oxide, 1,3,6-Triaza-phosphatricyclo[4.3.1.13,8]undecane, 8-oxide, 1,3,6-Triaza-8lambda~5~-phosphatricyclo[4.3.1.1~3,8~]undecan-8-one
| Molecular Formula | C7H14N3OP |
|---|---|
| Molecular Weight | 187.09 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 26.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 187.08745 |
| Heavy Atoms | 12 |
| Complexity | 237.0 |
Chemical Identifiers
| CAS Number | 56971-17-6 |
|---|---|
| SMILES | C1CN2CN3CN1CP(=O)(C2)C3 |
| InChIKey | JIENALKEKKGSTP-UHFFFAOYSA-N |
Product Overview
1,3,6-Triaza-phosphatricyclo(4.3.1.13,8)undecane, 8-oxide (CAS 56971-17-6), with molecular formula C7H14N3OP and molecular weight 187.09 g/mol. IUPAC: 1,3,6-triaza-8λ5-phosphatricyclo[4.3.1.13,8]undecane 8-oxide.
Chemical Property Profile of 1,3,6-Triaza-phosphatricyclo(4.3.1.13,8)undecane, 8-oxide
Property Insights of 1,3,6-Triaza-phosphatricyclo(4.3.1.13,8)undecane, 8-oxide
The XLogP value of -0.7 indicates that 1,3,6-Triaza-phosphatricyclo(4.3.1.13,8)undecane, 8-oxide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 26.8 Ų, 1,3,6-Triaza-phosphatricyclo(4.3.1.13,8)undecane, 8-oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3,6-Triaza-phosphatricyclo(4.3.1.13,8)undecane, 8-oxide has 0 hydrogen bond donor(s) and 4 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 1,3,6-Triaza-phosphatricyclo(4.3.1.13,8)undecane, 8-oxide?
The CAS number of 1,3,6-Triaza-phosphatricyclo(4.3.1.13,8)undecane, 8-oxide is 56971-17-6.
What is the molecular formula of 1,3,6-Triaza-phosphatricyclo(4.3.1.13,8)undecane, 8-oxide?
The molecular formula of 1,3,6-Triaza-phosphatricyclo(4.3.1.13,8)undecane, 8-oxide is C7H14N3OP.
What is the molecular weight of 1,3,6-Triaza-phosphatricyclo(4.3.1.13,8)undecane, 8-oxide?
The molecular weight of 1,3,6-Triaza-phosphatricyclo(4.3.1.13,8)undecane, 8-oxide is 187.09 g/mol.
Where can I buy 1,3,6-Triaza-phosphatricyclo(4.3.1.13,8)undecane, 8-oxide?
You can request a quote for 1,3,6-Triaza-phosphatricyclo(4.3.1.13,8)undecane, 8-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,6-Triaza-phosphatricyclo(4.3.1.13,8)undecane, 8-oxide?
Yes, KEHONG BIO provides custom synthesis services for 1,3,6-Triaza-phosphatricyclo(4.3.1.13,8)undecane, 8-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.