2-氯-2'-脱氧腺苷三磷酸酯
TL;DR: 2-氯-2'-脱氧腺苷三磷酸酯 (CAS 106867-30-5) is a chemical compound with molecular formula C10H15ClN5O12P3 and molecular weight 524.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-氯-2'-脱氧腺苷三磷酸酯
[[5-(6-amino-2-chloropurin-9-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
Also Known As: 2-Chloro-datp, 2-Chloro-2'-deoxyadenosine triphosphate, 2-Chloro-2'-deoxyadenosine-5'-triphosphate, Adenosine 5'-(tetrahydrogen triphosphate), 2-chloro-2'-deoxy-, [[5-(6-amino-2-chloropurin-9-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
| Molecular Formula | C10H15ClN5O12P3 |
|---|---|
| Molecular Weight | 524.96 g/mol |
| LogP | -3.0 |
| Topological Polar Surface Area | 259.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 8 |
| Exact Mass | 524.96185 |
| Heavy Atoms | 31 |
| Complexity | 805.0 |
Chemical Identifiers
| CAS Number | 106867-30-5 |
|---|---|
| SMILES | C1C(C(OC1N2C=NC3=C(N=C(N=C32)Cl)N)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O |
| InChIKey | PZCJNHCKXRBBNN-UHFFFAOYSA-N |
Product Overview
2-氯-2'-脱氧腺苷三磷酸酯 (CAS 106867-30-5), with molecular formula C10H15ClN5O12P3 and molecular weight 524.96 g/mol. IUPAC: [[5-(6-amino-2-chloropurin-9-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate.
Chemical Property Profile of 2-氯-2'-脱氧腺苷三磷酸酯
Property Insights of 2-氯-2'-脱氧腺苷三磷酸酯
The XLogP value of -3.0 indicates that 2-氯-2'-脱氧腺苷三磷酸酯 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 259.0 Ų indicates high polarity, suggesting 2-氯-2'-脱氧腺苷三磷酸酯 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-氯-2'-脱氧腺苷三磷酸酯 has 6 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-氯-2'-脱氧腺苷三磷酸酯?
The CAS number of 2-氯-2'-脱氧腺苷三磷酸酯 is 106867-30-5.
What is the molecular formula of 2-氯-2'-脱氧腺苷三磷酸酯?
The molecular formula of 2-氯-2'-脱氧腺苷三磷酸酯 is C10H15ClN5O12P3.
What is the molecular weight of 2-氯-2'-脱氧腺苷三磷酸酯?
The molecular weight of 2-氯-2'-脱氧腺苷三磷酸酯 is 524.96 g/mol.
Where can I buy 2-氯-2'-脱氧腺苷三磷酸酯?
You can request a quote for 2-氯-2'-脱氧腺苷三磷酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-氯-2'-脱氧腺苷三磷酸酯?
Yes, KEHONG BIO provides custom synthesis services for 2-氯-2'-脱氧腺苷三磷酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.