6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide structure

6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide

TL;DR: 6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide (CAS 6286-46-0) is a chemical compound with molecular formula C17H17N6O8P and molecular weight 464.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

6-(6-aminopurin-9-yl)-2-[(4-nitrophenyl)methoxy]-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol

Also Known As: 6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide, 6-(6-aminopurin-9-yl)-2-[(4-nitrophenyl)methoxy]-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol, 6-(6-Amino-9H-purin-9-yl)-7-hydroxy-2-[(4-nitrophenyl)methoxy]tetrahydro-2H,4H-2lambda~5~-furo[3,2-d][1,3,2]dioxaphosphinin-2-one

CAS: 6286-46-0
Molecular Formula C17H17N6O8P
Molecular Weight 464.08 g/mol
LogP -0.7
Topological Polar Surface Area 190.0 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 12
Rotatable Bonds 4
Exact Mass 464.08453
Heavy Atoms 32
Complexity 751.0

Chemical Identifiers

CAS Number 6286-46-0
SMILES C1C2C(C(C(O2)N3C=NC4=C(N=CN=C43)N)O)OP(=O)(O1)OCC5=CC=C(C=C5)[N+](=O)[O-]
InChIKey WBLNHPUJDGAYLB-UHFFFAOYSA-N

Product Overview

6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide (CAS 6286-46-0), with molecular formula C17H17N6O8P and molecular weight 464.08 g/mol. IUPAC: 6-(6-aminopurin-9-yl)-2-[(4-nitrophenyl)methoxy]-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol.

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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 6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide

XLogP
-0.7
TPSA (Topological Polar Surface Area)
190.0
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
12
Rotatable Bonds
4
Heavy Atoms
32
Complexity
751.0
Exact Mass
464.08453
Monoisotopic Mass
464.08453
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 6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide

The XLogP value of -0.7 indicates that 6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 190.0 Ų indicates high polarity, suggesting 6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide has 2 hydrogen bond donor(s) and 12 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 6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide?

The CAS number of 6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide is 6286-46-0.

What is the molecular formula of 6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide?

The molecular formula of 6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide is C17H17N6O8P.

What is the molecular weight of 6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide?

The molecular weight of 6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide is 464.08 g/mol.

Where can I buy 6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide?

You can request a quote for 6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for 6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide?

Yes, KEHONG BIO provides custom synthesis services for 6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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