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Diamsar chelate structure
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Diamsar chelate

TL;DR: Diamsar chelate (CAS 154599-98-1) is a chemical compound with molecular formula C14H34N8 and molecular weight 314.29065 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3,6,10,13,16,19-hexazabicyclo[6.6.6]icosane-1,8-diamine

Also Known As: Diamsar chelate, Diamsar, NH2-Sar-cage, diamine-sarcophagine, Diamsar Pentahydrate

CAS Number
154599-98-1
Molecular Formula
C14H34N8
Molecular Weight
314.29065 g/mol
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Technical Specifications

Molecular FormulaC14H34N8
Molecular Weight314.29065 g/mol
XLogP-4.9
Topological Polar Surface Area (TPSA)124.0 Ų
Hydrogen Bond Donors8
Hydrogen Bond Acceptors8
Rotatable Bonds0
Exact Mass314.29065 Da
Heavy Atoms22
Complexity238.0
SMILESC1CNCC2(CNCCNCC(CN1)(CNCCNC2)N)N
InChIKeyUQQQAKFVWNQYTP-UHFFFAOYSA-N

Chemical Property Profile of Diamsar chelate

XLogP
-4.9
TPSA (Topological Polar Surface Area)
124.0
Hydrogen Bond Donors
8
Hydrogen Bond Acceptors
8
Rotatable Bonds
0
Heavy Atoms
22
Complexity
238.0
Exact Mass
314.29065
Monoisotopic Mass
314.29065
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 Diamsar chelate

The XLogP value of -4.9 indicates that Diamsar chelate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Diamsar chelate. Following Lipinski's Rule of Five, Diamsar chelate has 8 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Diamsar chelate?

The CAS number of Diamsar chelate is 154599-98-1.

What is the molecular formula of Diamsar chelate?

The molecular formula of Diamsar chelate is C14H34N8.

What is the molecular weight of Diamsar chelate?

The molecular weight of Diamsar chelate is 314.29065 g/mol.

Where can I buy Diamsar chelate?

You can request a quote for Diamsar chelate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Diamsar chelate?

Yes, CoreyChem provides custom synthesis services for Diamsar chelate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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