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Methylenemescaline trimer structure
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Methylenemescaline trimer

TL;DR: Methylenemescaline trimer (CAS 125730-74-7) is a chemical compound with molecular formula C36H51N3O9 and molecular weight 669.36255 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1,3,5-tris[2-(3,4,5-trimethoxyphenyl)ethyl]-1,3,5-triazinane

Also Known As: Methylenemescaline trimer, 1,3,5-Tris[2-(3,4,5-trimethoxyphenyl)ethyl]-1,3,5-triazinane, Hexahydrotriazine,1,3,5-tri[2-(3,4,5-trimethoxy)phenethyl], 1,3,5-Tris[2-(3,4,5-trimethoxyphenyl)ethyl]-1,3,5-triazinane #, Hexahydrotriazine, 1,3,5-tri[2-(3,4,5-trimethoxy)phenethyl]-

CAS Number
125730-74-7
Molecular Formula
C36H51N3O9
Molecular Weight
669.36255 g/mol
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Technical Specifications

Molecular FormulaC36H51N3O9
Molecular Weight669.36255 g/mol
XLogP6.0
Topological Polar Surface Area (TPSA)92.8 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors12
Rotatable Bonds18
Exact Mass669.36255 Da
Heavy Atoms48
Complexity728.0
SMILESCOC1=CC(=CC(=C1OC)OC)CCN2CN(CN(C2)CCC3=CC(=C(C(=C3)OC)OC)OC)CCC4=CC(=C(C(=C4)OC)OC)OC
InChIKeyMLVMVLNTAYSMMT-UHFFFAOYSA-N

Chemical Property Profile of Methylenemescaline trimer

XLogP
6.0
TPSA (Topological Polar Surface Area)
92.8
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
12
Rotatable Bonds
18
Heavy Atoms
48
Complexity
728.0
Exact Mass
669.36255
Monoisotopic Mass
669.36255
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 Methylenemescaline trimer

The XLogP value of 6.0 indicates that Methylenemescaline trimer is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Methylenemescaline trimer. Following Lipinski's Rule of Five, Methylenemescaline trimer has 0 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 Methylenemescaline trimer?

The CAS number of Methylenemescaline trimer is 125730-74-7.

What is the molecular formula of Methylenemescaline trimer?

The molecular formula of Methylenemescaline trimer is C36H51N3O9.

What is the molecular weight of Methylenemescaline trimer?

The molecular weight of Methylenemescaline trimer is 669.36255 g/mol.

Where can I buy Methylenemescaline trimer?

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

Does CoreyChem offer custom synthesis for Methylenemescaline trimer?

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

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