Einecs 261-918-7
TL;DR: Einecs 261-918-7 (CAS 59766-07-3) is a chemical compound with molecular formula C11H22N2O6 and molecular weight 278.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
piperazine;trans-(3S,5S)-1,3,4,5-tetrahydroxycyclohexane-1-carboxylic acid
Also Known As: (3s,5s)-1,3,4,5-tetrahydroxycyclohexanecarboxylic acid- piperazine(1:1), Piperazine 1,3,4,5-tetrahydroxycyclohexane-1-carboxylate, 1,3,4,5-Tetrahydroxycyclohexane-1-carboxylic acid--piperazine (1/1), piperazine; (3S,5S)-1,3,4,5-tetrahydroxycyclohexane-1-carboxylic acid, (3S,5S)-1,3,4,5-Tetrahydroxycyclohexane-1-carboxylic acid--piperazine (1/1)
| Molecular Formula | C11H22N2O6 |
|---|---|
| Molecular Weight | 278.15 g/mol |
| LogP | -3.14 |
| Topological Polar Surface Area | 142.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 1 |
| Exact Mass | 278.1478 |
| Heavy Atoms | 19 |
| Complexity | 230.0 |
Chemical Identifiers
| CAS Number | 59766-07-3 |
|---|---|
| SMILES | C1CNCCN1.C1[C@@H](C([C@H](CC1(C(=O)O)O)O)O)O |
| InChIKey | ILELYUFCZWQXGV-VAYHLERTSA-N |
Product Overview
Einecs 261-918-7 (CAS 59766-07-3), with molecular formula C11H22N2O6 and molecular weight 278.15 g/mol. IUPAC: piperazine;trans-(3S,5S)-1,3,4,5-tetrahydroxycyclohexane-1-carboxylic acid.
Chemical Property Profile of Einecs 261-918-7
Property Insights of Einecs 261-918-7
The XLogP value of -3.14 indicates that Einecs 261-918-7 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 142.0 Ų indicates high polarity, suggesting Einecs 261-918-7 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Einecs 261-918-7 has 7 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Einecs 261-918-7?
The CAS number of Einecs 261-918-7 is 59766-07-3.
What is the molecular formula of Einecs 261-918-7?
The molecular formula of Einecs 261-918-7 is C11H22N2O6.
What is the molecular weight of Einecs 261-918-7?
The molecular weight of Einecs 261-918-7 is 278.15 g/mol.
Where can I buy Einecs 261-918-7?
You can request a quote for Einecs 261-918-7 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Einecs 261-918-7?
Yes, KEHONG BIO provides custom synthesis services for Einecs 261-918-7 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.