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1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate structure
Fine Chemical

1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate

TL;DR: 1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate (CAS 32838-28-1) is a chemical compound with molecular formula C16H29NO5 and molecular weight 315.20456 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

4-[4-(2-ethylhexylamino)-4-oxobutan-2-yl]oxy-4-oxobutanoic acid

Also Known As: butoctamide semisuccinate, Listomin S, Butoctamide, Butoctamide hydrogen succinate, Listomin

CAS Number
32838-28-1
Molecular Formula
C16H29NO5
Molecular Weight
315.20456 g/mol
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Technical Specifications

Molecular FormulaC16H29NO5
Molecular Weight315.20456 g/mol
XLogP2.4
Topological Polar Surface Area (TPSA)92.7 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors5
Rotatable Bonds13
Exact Mass315.20456 Da
Heavy Atoms22
Complexity356.0
SMILESCCCCC(CC)CNC(=O)CC(C)OC(=O)CCC(=O)O
InChIKeyCQONVBIGUJWUFE-UHFFFAOYSA-N

Product Description

Applications: 1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate (CAS 32838-28-1) is a fine chemical with the molecular formula C16H29NO5 and a molecular weight of 315.2 g/mol. Synonyms include butoctamide semisuccinate and Listomin S.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of 1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate

XLogP
2.4
TPSA (Topological Polar Surface Area)
92.7
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
5
Rotatable Bonds
13
Heavy Atoms
22
Complexity
356.0
Exact Mass
315.20456
Monoisotopic Mass
315.20456
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 1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate

The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate. The TPSA of 92.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate. Following Lipinski's Rule of Five, 1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate?

The CAS number of 1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate is 32838-28-1.

What is the molecular formula of 1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate?

The molecular formula of 1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate is C16H29NO5.

What is the molecular weight of 1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate?

The molecular weight of 1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate is 315.20456 g/mol.

What are the applications of 1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate?

1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full...

Where can I buy 1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate?

You can request a quote for 1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate?

Yes, CoreyChem provides custom synthesis services for 1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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