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RefChem:316381 structure
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RefChem:316381

TL;DR: RefChem:316381 (CAS 102585-64-8) is a chemical compound with molecular formula C26H30ClNO3 and molecular weight 439.1914 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1-(2-morpholin-4-ium-4-ylethoxy)-2,2,2-triphenylethanol chloride

Also Known As: 2,2,2-Triphenylacetic acid (2-morpholinoethyl) ester hydrochloride ethanoate, beta-4-Morpholine triphenylacetate monoalcoholate hydrochloride, 1-(2-morpholin-4-ium-4-ylethoxy)-2,2,2-triphenylethanol chloride, Acetic acid, 2,2,2-triphenyl-, (2-morpholinoethyl) ester, hydrochloride, ethanoate, 1-(2-morpholin-4-ium-4-ylethoxy)-2,2,2-triphenylethanol

CAS Number
102585-64-8
Molecular Formula
C26H30ClNO3
Molecular Weight
439.1914 g/mol
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Technical Specifications

Molecular FormulaC26H30ClNO3
Molecular Weight439.1914 g/mol
XLogP-0.72
Topological Polar Surface Area (TPSA)43.1 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors4
Rotatable Bonds8
Exact Mass439.1914 Da
Heavy Atoms31
Complexity429.0
SMILESC1COCC[NH+]1CCOC(C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)O.[Cl-]
InChIKeyNYJBIGCFHOWGQU-UHFFFAOYSA-N

Chemical Property Profile of RefChem:316381

XLogP
-0.72
TPSA (Topological Polar Surface Area)
43.1
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
4
Rotatable Bonds
8
Heavy Atoms
31
Complexity
429.0
Exact Mass
439.1914
Monoisotopic Mass
439.1914
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 RefChem:316381

The XLogP value of -0.72 indicates that RefChem:316381 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 43.1 Ų, RefChem:316381 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:316381 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of RefChem:316381?

The CAS number of RefChem:316381 is 102585-64-8.

What is the molecular formula of RefChem:316381?

The molecular formula of RefChem:316381 is C26H30ClNO3.

What is the molecular weight of RefChem:316381?

The molecular weight of RefChem:316381 is 439.1914 g/mol.

Where can I buy RefChem:316381?

You can request a quote for RefChem:316381 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for RefChem:316381?

Yes, CoreyChem provides custom synthesis services for RefChem:316381 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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