2-Propan-2-yladenosine 5'-(dihydrogen phosphate)
TL;DR: 2-Propan-2-yladenosine 5'-(dihydrogen phosphate) (CAS 7696-77-7) is a chemical compound with molecular formula C13H20N5O7P and molecular weight 389.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3S,4R,5R)-5-(6-amino-2-propan-2-ylpurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate
Also Known As: Poly(2'-isopropyladenylic acid), 2-propan-2-yladenosine 5'-(dihydrogen phosphate), 5'-Adenylic acid, 2-(1-methylethyl)-, homopolymer, 2-(Propan-2-yl)adenosine 5'-(dihydrogen phosphate), 9-(5-O-Phosphonopentofuranosyl)-2-(propan-2-yl)-9H-purin-6-amine
| Molecular Formula | C13H20N5O7P |
|---|---|
| Molecular Weight | 389.11 g/mol |
| LogP | -2.4 |
| Topological Polar Surface Area | 186.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 5 |
| Exact Mass | 389.11005 |
| Heavy Atoms | 26 |
| Complexity | 551.0 |
Chemical Identifiers
| CAS Number | 7696-77-7 |
|---|---|
| SMILES | CC(C)C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N |
| InChIKey | QGTFQPJASUNCSJ-HTVVRFAVSA-N |
Product Overview
2-Propan-2-yladenosine 5'-(dihydrogen phosphate) (CAS 7696-77-7), with molecular formula C13H20N5O7P and molecular weight 389.11 g/mol. IUPAC: [(2R,3S,4R,5R)-5-(6-amino-2-propan-2-ylpurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate.
Chemical Property Profile of 2-Propan-2-yladenosine 5'-(dihydrogen phosphate)
Property Insights of 2-Propan-2-yladenosine 5'-(dihydrogen phosphate)
The XLogP value of -2.4 indicates that 2-Propan-2-yladenosine 5'-(dihydrogen phosphate) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 186.0 Ų indicates high polarity, suggesting 2-Propan-2-yladenosine 5'-(dihydrogen phosphate) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-Propan-2-yladenosine 5'-(dihydrogen phosphate) has 5 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Propan-2-yladenosine 5'-(dihydrogen phosphate)?
The CAS number of 2-Propan-2-yladenosine 5'-(dihydrogen phosphate) is 7696-77-7.
What is the molecular formula of 2-Propan-2-yladenosine 5'-(dihydrogen phosphate)?
The molecular formula of 2-Propan-2-yladenosine 5'-(dihydrogen phosphate) is C13H20N5O7P.
What is the molecular weight of 2-Propan-2-yladenosine 5'-(dihydrogen phosphate)?
The molecular weight of 2-Propan-2-yladenosine 5'-(dihydrogen phosphate) is 389.11 g/mol.
Where can I buy 2-Propan-2-yladenosine 5'-(dihydrogen phosphate)?
You can request a quote for 2-Propan-2-yladenosine 5'-(dihydrogen phosphate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propan-2-yladenosine 5'-(dihydrogen phosphate)?
Yes, KEHONG BIO provides custom synthesis services for 2-Propan-2-yladenosine 5'-(dihydrogen phosphate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.