5-氨基-1,1-二甲基己基磷酸二氢酯
TL;DR: 5-氨基-1,1-二甲基己基磷酸二氢酯 (CAS 18864-28-3) is a chemical compound with molecular formula C8H20NO4P and molecular weight 225.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-氨基-1,1-二甲基己基磷酸二氢酯
(6-amino-2-methylheptan-2-yl) dihydrogen phosphate
Also Known As: 5-Amino-1,1-dimethylhexyl dihydrogen phosphate, 6-amino-2-methylheptan-2-yl dihydrogen phosphate, (6-amino-2-methylheptan-2-yl) dihydrogen phosphate, [(6-amino-2-methylheptan-2-yl)oxy]phosphonic acid, 2-Heptanol, 6-amino-2-methyl-, dihydrogen phosphate (ester)
| Molecular Formula | C8H20NO4P |
|---|---|
| Molecular Weight | 225.11 g/mol |
| LogP | -2.7 |
| Topological Polar Surface Area | 92.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 225.11299 |
| Heavy Atoms | 14 |
| Complexity | 213.0 |
Chemical Identifiers
| CAS Number | 18864-28-3 |
|---|---|
| SMILES | CC(CCCC(C)(C)OP(=O)(O)O)N |
| InChIKey | JUFGOWAGSGRBGQ-UHFFFAOYSA-N |
Product Overview
5-氨基-1,1-二甲基己基磷酸二氢酯 (CAS 18864-28-3), with molecular formula C8H20NO4P and molecular weight 225.11 g/mol. IUPAC: (6-amino-2-methylheptan-2-yl) dihydrogen phosphate.
Chemical Property Profile of 5-氨基-1,1-二甲基己基磷酸二氢酯
Property Insights of 5-氨基-1,1-二甲基己基磷酸二氢酯
The XLogP value of -2.7 indicates that 5-氨基-1,1-二甲基己基磷酸二氢酯 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 92.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-氨基-1,1-二甲基己基磷酸二氢酯. Following Lipinski's Rule of Five, 5-氨基-1,1-二甲基己基磷酸二氢酯 has 3 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 5-氨基-1,1-二甲基己基磷酸二氢酯?
The CAS number of 5-氨基-1,1-二甲基己基磷酸二氢酯 is 18864-28-3.
What is the molecular formula of 5-氨基-1,1-二甲基己基磷酸二氢酯?
The molecular formula of 5-氨基-1,1-二甲基己基磷酸二氢酯 is C8H20NO4P.
What is the molecular weight of 5-氨基-1,1-二甲基己基磷酸二氢酯?
The molecular weight of 5-氨基-1,1-二甲基己基磷酸二氢酯 is 225.11 g/mol.
Where can I buy 5-氨基-1,1-二甲基己基磷酸二氢酯?
You can request a quote for 5-氨基-1,1-二甲基己基磷酸二氢酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-氨基-1,1-二甲基己基磷酸二氢酯?
Yes, KEHONG BIO provides custom synthesis services for 5-氨基-1,1-二甲基己基磷酸二氢酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.