3'-OHCH2-Ara-5-Carboxyvinyl-U
TL;DR: 3'-OHCH2-Ara-5-Carboxyvinyl-U (CAS 130351-62-1) is a chemical compound with molecular formula C13H16N2O8 and molecular weight 328.09067 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-3-[1-[(2R,3S,4S,5S)-3-hydroxy-4,5-bis(hydroxymethyl)oxolan-2-yl]-2,4-dioxopyrimidin-5-yl]prop-2-enoic acid
Also Known As: 3'-OHCH2-Ara-5-Carboxyvinyl-U, (E)-5-(2-Carboxyvinyl)-1-(3-deoxy-3-C-(hydroxymethyl)-beta-D-arabino-pentofuranosyl)uracil, 2-Propenoic acid, 3-(1-(3-deoxy-3-(hydroxymethyl)-beta-D-arabinofuranosyl)-1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinyl)-, (E)-, (E)-3-[1-[(2R,3S,4S,5S)-3-hydroxy-4,5-bis(hydroxymethyl)oxolan-2-yl]-2,4-dioxopyrimidin-5-yl]prop-2-enoic acid, (E)-3-[1-[(2R,3S,4S,5S)-3-hydroxy-4,5-bis(hydroxymethyl)tetrahydrofuran-2-yl]-2,4-dioxo-pyrimidin-5-yl]prop-2-enoic acid
Technical Specifications
| Molecular Formula | C13H16N2O8 |
| Molecular Weight | 328.09067 g/mol |
| XLogP | -2.2 |
| Topological Polar Surface Area (TPSA) | 157.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 328.09067 Da |
| Heavy Atoms | 23 |
| Complexity | 572.0 |
| SMILES | C1=C(C(=O)NC(=O)N1[C@H]2[C@H]([C@@H]([C@H](O2)CO)CO)O)/C=C/C(=O)O |
| InChIKey | YOJOKHXODXHCBB-JKIHDMHCSA-N |
Chemical Property Profile of 3'-OHCH2-Ara-5-Carboxyvinyl-U
Property Insights of 3'-OHCH2-Ara-5-Carboxyvinyl-U
The XLogP value of -2.2 indicates that 3'-OHCH2-Ara-5-Carboxyvinyl-U is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 157.0 Ų indicates high polarity, suggesting 3'-OHCH2-Ara-5-Carboxyvinyl-U may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3'-OHCH2-Ara-5-Carboxyvinyl-U has 5 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3'-OHCH2-Ara-5-Carboxyvinyl-U?
The CAS number of 3'-OHCH2-Ara-5-Carboxyvinyl-U is 130351-62-1.
What is the molecular formula of 3'-OHCH2-Ara-5-Carboxyvinyl-U?
The molecular formula of 3'-OHCH2-Ara-5-Carboxyvinyl-U is C13H16N2O8.
What is the molecular weight of 3'-OHCH2-Ara-5-Carboxyvinyl-U?
The molecular weight of 3'-OHCH2-Ara-5-Carboxyvinyl-U is 328.09067 g/mol.
Where can I buy 3'-OHCH2-Ara-5-Carboxyvinyl-U?
You can request a quote for 3'-OHCH2-Ara-5-Carboxyvinyl-U directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3'-OHCH2-Ara-5-Carboxyvinyl-U?
Yes, CoreyChem provides custom synthesis services for 3'-OHCH2-Ara-5-Carboxyvinyl-U and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.