(2-Amino-3-hydroxyoctadec-4-enyl) bis[1-(2-nitrophenyl)ethyl] phosphate structure

(2-Amino-3-hydroxyoctadec-4-enyl) bis[1-(2-nitrophenyl)ethyl] phosphate

TL;DR: (2-Amino-3-hydroxyoctadec-4-enyl) bis[1-(2-nitrophenyl)ethyl] phosphate (CAS 207516-11-8) is a chemical compound with molecular formula C34H52N3O9P and molecular weight 677.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

(2-amino-3-hydroxyoctadec-4-enyl) bis[1-(2-nitrophenyl)ethyl] phosphate

Also Known As: Caged D-erythro-Sphingosine-1-phosphate, (2-amino-3-hydroxyoctadec-4-enyl) bis[1-(2-nitrophenyl)ethyl] phosphate, 2-amino-1-[bis[1-(2-nitrophenyl)ethoxy]phosphoryloxy]octadec-4-en-3-ol

CAS: 207516-11-8
Molecular Formula C34H52N3O9P
Molecular Weight 677.34 g/mol
LogP 9.4286
Topological Polar Surface Area 177.29 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 10
Rotatable Bonds 25
Exact Mass 677.3441
Heavy Atoms 47
Complexity 1239.612

Chemical Identifiers

CAS Number 207516-11-8
SMILES CCCCCCCCCCCCCC=CC(C(COP(=O)(OC(C)C1=CC=CC=C1[N+](=O)[O-])OC(C)C2=CC=CC=C2[N+](=O)[O-])N)O

Product Overview

(2-Amino-3-hydroxyoctadec-4-enyl) bis[1-(2-nitrophenyl)ethyl] phosphate (CAS 207516-11-8), with molecular formula C34H52N3O9P and molecular weight 677.34 g/mol. IUPAC: (2-amino-3-hydroxyoctadec-4-enyl) bis[1-(2-nitrophenyl)ethyl] phosphate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of (2-Amino-3-hydroxyoctadec-4-enyl) bis[1-(2-nitrophenyl)ethyl] phosphate

XLogP
9.4286
TPSA (Topological Polar Surface Area)
177.29
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
10
Rotatable Bonds
25
Heavy Atoms
47
Complexity
1239.612
Exact Mass
677.3441
Monoisotopic Mass
677.3441
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of (2-Amino-3-hydroxyoctadec-4-enyl) bis[1-(2-nitrophenyl)ethyl] phosphate

The XLogP value of 9.4286 indicates that (2-Amino-3-hydroxyoctadec-4-enyl) bis[1-(2-nitrophenyl)ethyl] phosphate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 177.29 Ų indicates high polarity, suggesting (2-Amino-3-hydroxyoctadec-4-enyl) bis[1-(2-nitrophenyl)ethyl] phosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (2-Amino-3-hydroxyoctadec-4-enyl) bis[1-(2-nitrophenyl)ethyl] phosphate has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of (2-Amino-3-hydroxyoctadec-4-enyl) bis[1-(2-nitrophenyl)ethyl] phosphate?

The CAS number of (2-Amino-3-hydroxyoctadec-4-enyl) bis[1-(2-nitrophenyl)ethyl] phosphate is 207516-11-8.

What is the molecular formula of (2-Amino-3-hydroxyoctadec-4-enyl) bis[1-(2-nitrophenyl)ethyl] phosphate?

The molecular formula of (2-Amino-3-hydroxyoctadec-4-enyl) bis[1-(2-nitrophenyl)ethyl] phosphate is C34H52N3O9P.

What is the molecular weight of (2-Amino-3-hydroxyoctadec-4-enyl) bis[1-(2-nitrophenyl)ethyl] phosphate?

The molecular weight of (2-Amino-3-hydroxyoctadec-4-enyl) bis[1-(2-nitrophenyl)ethyl] phosphate is 677.34 g/mol.

Where can I buy (2-Amino-3-hydroxyoctadec-4-enyl) bis[1-(2-nitrophenyl)ethyl] phosphate?

You can request a quote for (2-Amino-3-hydroxyoctadec-4-enyl) bis[1-(2-nitrophenyl)ethyl] phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for (2-Amino-3-hydroxyoctadec-4-enyl) bis[1-(2-nitrophenyl)ethyl] phosphate?

Yes, KEHONG BIO provides custom synthesis services for (2-Amino-3-hydroxyoctadec-4-enyl) bis[1-(2-nitrophenyl)ethyl] phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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