2-Bromoethyl [2-(hexadecanoylamino)-4-nitrophenyl] hydrogen phosphate
TL;DR: 2-Bromoethyl [2-(hexadecanoylamino)-4-nitrophenyl] hydrogen phosphate (CAS 60301-90-8) is a chemical compound with molecular formula C24H40BrN2O7P and molecular weight 578.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromoethyl [2-(hexadecanoylamino)-4-nitrophenyl] hydrogen phosphate
Also Known As: 2-bromoethyl [2-(hexadecanoylamino)-4-nitrophenyl] hydrogen phosphate, 2'-(beta-Bromoethylphosphoryl)-5'-nitrohexadecananilide, 2'-(-Bromoethylphosphoryl)-5'-nitrohexadecananilide, 2'-(, A-Bromoethylphosphoryl)-5'-nitrohexadecananilide
| Molecular Formula | C24H40BrN2O7P |
|---|---|
| Molecular Weight | 578.18 g/mol |
| LogP | 7.9053 |
| Topological Polar Surface Area | 128.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 21 |
| Exact Mass | 578.17566 |
| Heavy Atoms | 35 |
| Complexity | 810.07733 |
Chemical Identifiers
| CAS Number | 60301-90-8 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OP(=O)(O)OCCBr |
Product Overview
2-Bromoethyl [2-(hexadecanoylamino)-4-nitrophenyl] hydrogen phosphate (CAS 60301-90-8), with molecular formula C24H40BrN2O7P and molecular weight 578.18 g/mol. IUPAC: 2-bromoethyl [2-(hexadecanoylamino)-4-nitrophenyl] hydrogen phosphate.
Chemical Property Profile of 2-Bromoethyl [2-(hexadecanoylamino)-4-nitrophenyl] hydrogen phosphate
Property Insights of 2-Bromoethyl [2-(hexadecanoylamino)-4-nitrophenyl] hydrogen phosphate
The XLogP value of 7.9053 indicates that 2-Bromoethyl [2-(hexadecanoylamino)-4-nitrophenyl] hydrogen phosphate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 128.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Bromoethyl [2-(hexadecanoylamino)-4-nitrophenyl] hydrogen phosphate. Following Lipinski's Rule of Five, 2-Bromoethyl [2-(hexadecanoylamino)-4-nitrophenyl] hydrogen phosphate has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Bromoethyl [2-(hexadecanoylamino)-4-nitrophenyl] hydrogen phosphate?
The CAS number of 2-Bromoethyl [2-(hexadecanoylamino)-4-nitrophenyl] hydrogen phosphate is 60301-90-8.
What is the molecular formula of 2-Bromoethyl [2-(hexadecanoylamino)-4-nitrophenyl] hydrogen phosphate?
The molecular formula of 2-Bromoethyl [2-(hexadecanoylamino)-4-nitrophenyl] hydrogen phosphate is C24H40BrN2O7P.
What is the molecular weight of 2-Bromoethyl [2-(hexadecanoylamino)-4-nitrophenyl] hydrogen phosphate?
The molecular weight of 2-Bromoethyl [2-(hexadecanoylamino)-4-nitrophenyl] hydrogen phosphate is 578.18 g/mol.
Where can I buy 2-Bromoethyl [2-(hexadecanoylamino)-4-nitrophenyl] hydrogen phosphate?
You can request a quote for 2-Bromoethyl [2-(hexadecanoylamino)-4-nitrophenyl] hydrogen phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromoethyl [2-(hexadecanoylamino)-4-nitrophenyl] hydrogen phosphate?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromoethyl [2-(hexadecanoylamino)-4-nitrophenyl] hydrogen phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.