EINECS 302-339-2
TL;DR: EINECS 302-339-2 (CAS 75522-97-3) is a chemical compound with molecular formula C20H24Li5N10O22P5 and molecular weight 946.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pentalithium;bis[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl]oxy-oxidophosphoryl] phosphate
Also Known As: EINECS 302-339-2, Diadenosine pentaphosphate trilithium salt, Adenosine 5'-(hexahydrogen pentaphosphate), 5'.5'-ester with adenosine, pentalithium salt, P1,P5-Di(adenosine-5') pentaphosphate pentalithium salt, Diadenosine pentaphosphate pentalithium salt
| Molecular Formula | C20H24Li5N10O22P5 |
|---|---|
| Molecular Weight | 946.06 g/mol |
| LogP | -20.4694 |
| Topological Polar Surface Area | 494.65 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 30 |
| Rotatable Bonds | 16 |
| Exact Mass | 946.0555 |
| Heavy Atoms | 62 |
| Complexity | 2253.4395 |
Chemical Identifiers
| CAS Number | 75522-97-3 |
|---|---|
| SMILES | [Li+].[Li+].[Li+].[Li+].[Li+].C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)([O-])OP(=O)([O-])OP(=O)([O-])OP(=O)([O-])OP(=O)([O-])OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)N |
Product Overview
EINECS 302-339-2 (CAS 75522-97-3), with molecular formula C20H24Li5N10O22P5 and molecular weight 946.06 g/mol. IUPAC: pentalithium;bis[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl]oxy-oxidophosphoryl] phosphate.
Chemical Property Profile of EINECS 302-339-2
Property Insights of EINECS 302-339-2
The XLogP value of -20.4694 indicates that EINECS 302-339-2 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 494.65 Ų indicates high polarity, suggesting EINECS 302-339-2 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, EINECS 302-339-2 has 6 hydrogen bond donor(s) and 30 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of EINECS 302-339-2?
The CAS number of EINECS 302-339-2 is 75522-97-3.
What is the molecular formula of EINECS 302-339-2?
The molecular formula of EINECS 302-339-2 is C20H24Li5N10O22P5.
What is the molecular weight of EINECS 302-339-2?
The molecular weight of EINECS 302-339-2 is 946.06 g/mol.
Where can I buy EINECS 302-339-2?
You can request a quote for EINECS 302-339-2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 302-339-2?
Yes, KEHONG BIO provides custom synthesis services for EINECS 302-339-2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.