双(环己基铵)4-硝基磷酸盐
TL;DR: 双(环己基铵)4-硝基磷酸盐 (CAS 14545-82-5) is a chemical compound with molecular formula C18H32N3O6P and molecular weight 417.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
双(环己基铵)4-硝基磷酸盐
bis(cyclohexanamine);(3-nitrophenyl) dihydrogen phosphate
Also Known As: p-nitrophenyl phosphate, Bis(cyclohexylammonium) 4-nitrophosphate, C6H13N.1/2C6H6NO6P, 4-NITROPHENYL PHOSPHATE BIS(CYCLOHEXYL-, cyclohexanamine;(3-nitrophenyl) dihydrogen phosphate
| Molecular Formula | C18H32N3O6P |
|---|---|
| Molecular Weight | 417.20 g/mol |
| LogP | 3.62 |
| Topological Polar Surface Area | 165.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 417.20288 |
| Heavy Atoms | 28 |
| Complexity | 304.0 |
Chemical Identifiers
| CAS Number | 14545-82-5 |
|---|---|
| SMILES | C1CCC(CC1)N.C1CCC(CC1)N.C1=CC(=CC(=C1)OP(=O)(O)O)[N+](=O)[O-] |
| InChIKey | WFZPCUTUPMTDAW-UHFFFAOYSA-N |
Product Overview
双(环己基铵)4-硝基磷酸盐 (CAS 14545-82-5), with molecular formula C18H32N3O6P and molecular weight 417.20 g/mol. IUPAC: bis(cyclohexanamine);(3-nitrophenyl) dihydrogen phosphate.
Chemical Property Profile of 双(环己基铵)4-硝基磷酸盐
Property Insights of 双(环己基铵)4-硝基磷酸盐
The XLogP value of 3.62 indicates that 双(环己基铵)4-硝基磷酸盐 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 165.0 Ų indicates high polarity, suggesting 双(环己基铵)4-硝基磷酸盐 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 双(环己基铵)4-硝基磷酸盐 has 4 hydrogen bond donor(s) and 8 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 双(环己基铵)4-硝基磷酸盐?
The CAS number of 双(环己基铵)4-硝基磷酸盐 is 14545-82-5.
What is the molecular formula of 双(环己基铵)4-硝基磷酸盐?
The molecular formula of 双(环己基铵)4-硝基磷酸盐 is C18H32N3O6P.
What is the molecular weight of 双(环己基铵)4-硝基磷酸盐?
The molecular weight of 双(环己基铵)4-硝基磷酸盐 is 417.20 g/mol.
Where can I buy 双(环己基铵)4-硝基磷酸盐?
You can request a quote for 双(环己基铵)4-硝基磷酸盐 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 双(环己基铵)4-硝基磷酸盐?
Yes, KEHONG BIO provides custom synthesis services for 双(环己基铵)4-硝基磷酸盐 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.