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Alloferin structure
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Alloferin

TL;DR: Alloferin (CAS 15180-03-7) is a chemical compound with molecular formula C44H50Cl2N4O2 and molecular weight 736.33105 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(2E)-2-[(9Z,25Z,38E)-38-(2-hydroxyethylidene)-14,30-bis(prop-2-enyl)-8,24-diaza-14,30-diazoniaundecacyclo[25.5.2.211,14.11,26.110,17.02,7.013,17.018,23.030,33.08,35.024,36]octatriaconta-2,4,6,9,18,20,22,25-octaen-28-ylidene]ethanol dichloride

Also Known As: Alloferin, Dialferin, Allyl-toxiferin, Alcuronium chloride, Alcuronii chloridum

CAS Number
15180-03-7
Molecular Formula
C44H50Cl2N4O2
Molecular Weight
736.33105 g/mol
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Technical Specifications

Molecular FormulaC44H50Cl2N4O2
Molecular Weight736.33105 g/mol
XLogP-0.5164
Topological Polar Surface Area (TPSA)46.9 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors6
Rotatable Bonds6
Exact Mass736.33105 Da
Heavy Atoms52
Complexity1510.0
SMILESC=CC[N+]12C3C4(C5=CC=CC=C5N/6C4/C(=C\N7C8/C(=C6)/C9/C(=C\CO)/C[N+]4(C(C8(C5=CC=CC=C75)CC4)C9)CC=C)/C(C3)/C(=C\CO)/C1)CC2.[Cl-].[Cl-]
InChIKeyCPYGBGOXCJJJGC-KFXHDRJVSA-L

Chemical Property Profile of Alloferin

XLogP
-0.5164
TPSA (Topological Polar Surface Area)
46.9
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
6
Rotatable Bonds
6
Heavy Atoms
52
Complexity
1510.0
Exact Mass
736.33105
Monoisotopic Mass
736.33105
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 Alloferin

The XLogP value of -0.5164 indicates that Alloferin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 46.9 Ų, Alloferin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Alloferin has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Alloferin?

The CAS number of Alloferin is 15180-03-7.

What is the molecular formula of Alloferin?

The molecular formula of Alloferin is C44H50Cl2N4O2.

What is the molecular weight of Alloferin?

The molecular weight of Alloferin is 736.33105 g/mol.

Where can I buy Alloferin?

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

Does CoreyChem offer custom synthesis for Alloferin?

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

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