2-[1-(4-amino-2-oxopyrimidin-1-yl)-2-oxoethoxy]-3-hydroxypro structure

2-[1-(4-amino-2-oxopyrimidin-1-yl)-2-oxoethoxy]-3-hydroxypro

TL;DR: 2-[1-(4-amino-2-oxopyrimidin-1-yl)-2-oxoethoxy]-3-hydroxypro (CAS 13466-76-7) is a chemical compound with molecular formula C15H14N6O12 and molecular weight 470.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

2-[1-(4-amino-2-oxopyrimidin-1-yl)-2-oxoethoxy]-3-hydroxypropanal;2,4,6-trinitrophenol

Also Known As: 2-[1-(4-amino-2-oxopyrimidin-1-yl)-2-oxoethoxy]-3-hydroxypro, 2-[1-(4-amino-2-oxopyrimidin-1-yl)-2-oxoethoxy]-3-hydroxypropanal; 2,4,6-trinitrophenol, 2-[1-(4-Amino-2-oxopyrimidin-1-yl)-2-oxoethoxy]-3-hydroxypropanal;2,4,6-trinitrophenol, 2-[1-(4-Amino-2-oxopyrimidin-1(2H)-yl)-2-oxoethoxy]-3-hydroxypropanal--2,4,6-trinitrophenol (1/1)

CAS: 13466-76-7
Molecular Formula C15H14N6O12
Molecular Weight 470.07 g/mol
LogP -0.7838
Topological Polar Surface Area 280.0 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 12
Rotatable Bonds 6
Exact Mass 470.06696
Heavy Atoms 33
Complexity 670.0

Chemical Identifiers

CAS Number 13466-76-7
SMILES C1=CN(C(=O)N=C1N)C(C=O)OC(CO)C=O.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]
InChIKey RLYCGLZRRBRECB-UHFFFAOYSA-N

Product Overview

2-[1-(4-amino-2-oxopyrimidin-1-yl)-2-oxoethoxy]-3-hydroxypro (CAS 13466-76-7), with molecular formula C15H14N6O12 and molecular weight 470.07 g/mol. IUPAC: 2-[1-(4-amino-2-oxopyrimidin-1-yl)-2-oxoethoxy]-3-hydroxypropanal;2,4,6-trinitrophenol.

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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-[1-(4-amino-2-oxopyrimidin-1-yl)-2-oxoethoxy]-3-hydroxypro

XLogP
-0.7838
TPSA (Topological Polar Surface Area)
280.0
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
12
Rotatable Bonds
6
Heavy Atoms
33
Complexity
670.0
Exact Mass
470.06696
Monoisotopic Mass
470.06696
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-[1-(4-amino-2-oxopyrimidin-1-yl)-2-oxoethoxy]-3-hydroxypro

The XLogP value of -0.7838 indicates that 2-[1-(4-amino-2-oxopyrimidin-1-yl)-2-oxoethoxy]-3-hydroxypro is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 280.0 Ų indicates high polarity, suggesting 2-[1-(4-amino-2-oxopyrimidin-1-yl)-2-oxoethoxy]-3-hydroxypro may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-[1-(4-amino-2-oxopyrimidin-1-yl)-2-oxoethoxy]-3-hydroxypro has 3 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 2-[1-(4-amino-2-oxopyrimidin-1-yl)-2-oxoethoxy]-3-hydroxypro?

The CAS number of 2-[1-(4-amino-2-oxopyrimidin-1-yl)-2-oxoethoxy]-3-hydroxypro is 13466-76-7.

What is the molecular formula of 2-[1-(4-amino-2-oxopyrimidin-1-yl)-2-oxoethoxy]-3-hydroxypro?

The molecular formula of 2-[1-(4-amino-2-oxopyrimidin-1-yl)-2-oxoethoxy]-3-hydroxypro is C15H14N6O12.

What is the molecular weight of 2-[1-(4-amino-2-oxopyrimidin-1-yl)-2-oxoethoxy]-3-hydroxypro?

The molecular weight of 2-[1-(4-amino-2-oxopyrimidin-1-yl)-2-oxoethoxy]-3-hydroxypro is 470.07 g/mol.

Where can I buy 2-[1-(4-amino-2-oxopyrimidin-1-yl)-2-oxoethoxy]-3-hydroxypro?

You can request a quote for 2-[1-(4-amino-2-oxopyrimidin-1-yl)-2-oxoethoxy]-3-hydroxypro directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for 2-[1-(4-amino-2-oxopyrimidin-1-yl)-2-oxoethoxy]-3-hydroxypro?

Yes, KEHONG BIO provides custom synthesis services for 2-[1-(4-amino-2-oxopyrimidin-1-yl)-2-oxoethoxy]-3-hydroxypro and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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