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2,3-Oxetanedimethanol, 4-(4-amino-7H-imidazo(4,5-d)-1,2,3-triazin-7-yl)-2- (dihydrogenphosphate), disodium salt, (2S-(2-alpha,3-beta,4-alpha))- structure
Fine Chemical

2,3-Oxetanedimethanol, 4-(4-amino-7H-imidazo(4,5-d)-1,2,3-triazin-7-yl)-2- (dihydrogenphosphate), disodium salt, (2S-(2-alpha,3-beta,4-alpha))-

TL;DR: 2,3-Oxetanedimethanol, 4-(4-amino-7H-imidazo(4,5-d)-1,2,3-triazin-7-yl)-2- (dihydrogenphosphate), disodium salt, (2S-(2-alpha,3-beta,4-alpha))- (CAS 136105-26-5) is a chemical compound with molecular formula C9H11N6Na2O7P and molecular weight 392.02222 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

disodium;[(2S,3R,4R)-4-(4-aminoimidazo[4,5-d]triazin-7-yl)-2-(oxidomethyl)-2-phosphonooxyoxetan-3-yl]methanolate

Also Known As: 2,3-Oxetanedimethanol, 4-(4-amino-7H-imidazo(4,5-d)-1,2,3-triazin-7-yl)-2- (dihydrogenphosphate), disodium salt, (2S-(2-alpha,3-beta,4-alpha))-, 2,3-Oxetanedimethanol, 4-(4-amino-7H-imidazo(4,5-d)-1,2,3-triazin-7-yl)-2-(dihydrogenphosphate), disodium salt, (2S-(2-alpha,3-beta,4-alpha))-, Disodium [(2S,3R,4R)-4-(4-amino-7H-imidazo[4,5-d][1,2,3]triazin-7-yl)-2-(phosphonooxy)oxetane-2,3-diyl]dimethanolate, disodium [(2S,3R,4R)-4-(4-aminoimidazo[4,5-d]triazin-7-yl)-2-(oxidomethyl)-2-phosphonooxyoxetan-3-yl]methanolate

CAS Number
136105-26-5
Molecular Formula
C9H11N6Na2O7P
Molecular Weight
392.02222 g/mol
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Technical Specifications

Molecular FormulaC9H11N6Na2O7P
Molecular Weight392.02222 g/mol
XLogP-9.5173
Topological Polar Surface Area (TPSA)205.0 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors12
Rotatable Bonds5
Exact Mass392.02222 Da
Heavy Atoms25
Complexity495.0
SMILESC1=NC2=C(N=NN=C2N1[C@H]3[C@H]([C@@](O3)(C[O-])OP(=O)(O)O)C[O-])N.[Na+].[Na+]
InChIKeyCVFBTLPBZZWVOO-LUFSZRTCSA-N

Chemical Property Profile of 2,3-Oxetanedimethanol, 4-(4-amino-7H-imidazo(4,5-d)-1,2,3-triazin-7-yl)-2- (dihydrogenphosphate), disodium salt, (2S-(2-alpha,3-beta,4-alpha))-

XLogP
-9.5173
TPSA (Topological Polar Surface Area)
205.0
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
12
Rotatable Bonds
5
Heavy Atoms
25
Complexity
495.0
Exact Mass
392.02222
Monoisotopic Mass
392.02222
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 2,3-Oxetanedimethanol, 4-(4-amino-7H-imidazo(4,5-d)-1,2,3-triazin-7-yl)-2- (dihydrogenphosphate), disodium salt, (2S-(2-alpha,3-beta,4-alpha))-

The XLogP value of -9.5173 indicates that 2,3-Oxetanedimethanol, 4-(4-amino-7H-imidazo(4,5-d)-1,2,3-triazin-7-yl)-2- (dihydrogenphosphate), disodium salt, (2S-(2-alpha,3-beta,4-alpha))- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 205.0 Ų indicates high polarity, suggesting 2,3-Oxetanedimethanol, 4-(4-amino-7H-imidazo(4,5-d)-1,2,3-triazin-7-yl)-2- (dihydrogenphosphate), disodium salt, (2S-(2-alpha,3-beta,4-alpha))- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2,3-Oxetanedimethanol, 4-(4-amino-7H-imidazo(4,5-d)-1,2,3-triazin-7-yl)-2- (dihydrogenphosphate), disodium salt, (2S-(2-alpha,3-beta,4-alpha))- 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 CAS number of 2,3-Oxetanedimethanol, 4-(4-amino-7H-imidazo(4,5-d)-1,2,3-triazin-7-yl)-2- (dihydrogenphosphate), disodium salt, (2S-(2-alpha,3-beta,4-alpha))-?

The CAS number of 2,3-Oxetanedimethanol, 4-(4-amino-7H-imidazo(4,5-d)-1,2,3-triazin-7-yl)-2- (dihydrogenphosphate), disodium salt, (2S-(2-alpha,3-beta,4-alpha))- is 136105-26-5.

What is the molecular formula of 2,3-Oxetanedimethanol, 4-(4-amino-7H-imidazo(4,5-d)-1,2,3-triazin-7-yl)-2- (dihydrogenphosphate), disodium salt, (2S-(2-alpha,3-beta,4-alpha))-?

The molecular formula of 2,3-Oxetanedimethanol, 4-(4-amino-7H-imidazo(4,5-d)-1,2,3-triazin-7-yl)-2- (dihydrogenphosphate), disodium salt, (2S-(2-alpha,3-beta,4-alpha))- is C9H11N6Na2O7P.

What is the molecular weight of 2,3-Oxetanedimethanol, 4-(4-amino-7H-imidazo(4,5-d)-1,2,3-triazin-7-yl)-2- (dihydrogenphosphate), disodium salt, (2S-(2-alpha,3-beta,4-alpha))-?

The molecular weight of 2,3-Oxetanedimethanol, 4-(4-amino-7H-imidazo(4,5-d)-1,2,3-triazin-7-yl)-2- (dihydrogenphosphate), disodium salt, (2S-(2-alpha,3-beta,4-alpha))- is 392.02222 g/mol.

Where can I buy 2,3-Oxetanedimethanol, 4-(4-amino-7H-imidazo(4,5-d)-1,2,3-triazin-7-yl)-2- (dihydrogenphosphate), disodium salt, (2S-(2-alpha,3-beta,4-alpha))-?

You can request a quote for 2,3-Oxetanedimethanol, 4-(4-amino-7H-imidazo(4,5-d)-1,2,3-triazin-7-yl)-2- (dihydrogenphosphate), disodium salt, (2S-(2-alpha,3-beta,4-alpha))- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2,3-Oxetanedimethanol, 4-(4-amino-7H-imidazo(4,5-d)-1,2,3-triazin-7-yl)-2- (dihydrogenphosphate), disodium salt, (2S-(2-alpha,3-beta,4-alpha))-?

Yes, CoreyChem provides custom synthesis services for 2,3-Oxetanedimethanol, 4-(4-amino-7H-imidazo(4,5-d)-1,2,3-triazin-7-yl)-2- (dihydrogenphosphate), disodium salt, (2S-(2-alpha,3-beta,4-alpha))- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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