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N1-(4-Aminobutyl)-1,4-butanediamine structure
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N1-(4-Aminobutyl)-1,4-butanediamine

TL;DR: N1-(4-Aminobutyl)-1,4-butanediamine (CAS 4427-76-3) is a chemical compound with molecular formula C8H21N3 and molecular weight 159.17355 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N'-(4-aminobutyl)butane-1,4-diamine

Also Known As: sym-homospermidine, Homospermidine, bis(4-aminobutyl)amine, 1,6,11-triazaundecane, N1-(4-aminobutyl)butane-1,4-diamine

CAS Number
4427-76-3
Molecular Formula
C8H21N3
Molecular Weight
159.17355 g/mol
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Application Areas

Top 5 of 19 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (10 patents) Analytical Reagents (3 patents) Catalysts (10 patents) Coatings & Adhesives (63 patents) Construction Chemicals (21 patents)

Technical Specifications

Molecular FormulaC8H21N3
Molecular Weight159.17355 g/mol
XLogP-0.7
Topological Polar Surface Area (TPSA)64.1 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors3
Rotatable Bonds8
Exact Mass159.17355 Da
Heavy Atoms11
Complexity58.0
SMILESC(CCNCCCCN)CN
InChIKeyUODZHRGDSPLRMD-UHFFFAOYSA-N

Product Description

Applications: N1-(4-Aminobutyl)-1,4-butanediamine is used in polymer chemistry and functional materials synthesis, as well as lubricant and fuel additive formulations. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies N1-(4-Aminobutyl)-1,4-butanediamine (CAS 4427-76-3) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

N1-(4-Aminobutyl)-1,4-butanediamine is a polymer intermediate identified by CAS number 4427-76-3 and the molecular formula C8H21N3 and a molecular weight of 159.17 g/mol. It is also known as sym-homospermidine and Homospermidine.

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 N1-(4-Aminobutyl)-1,4-butanediamine

XLogP
-0.7
TPSA (Topological Polar Surface Area)
64.1
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
3
Rotatable Bonds
8
Heavy Atoms
11
Complexity
58.0
Exact Mass
159.17355
Monoisotopic Mass
159.17355
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 N1-(4-Aminobutyl)-1,4-butanediamine

The XLogP value of -0.7 indicates that N1-(4-Aminobutyl)-1,4-butanediamine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 64.1 Ų falls within the moderate polarity range, balancing permeability and solubility for N1-(4-Aminobutyl)-1,4-butanediamine. Following Lipinski's Rule of Five, N1-(4-Aminobutyl)-1,4-butanediamine has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of N1-(4-Aminobutyl)-1,4-butanediamine?

The CAS number of N1-(4-Aminobutyl)-1,4-butanediamine is 4427-76-3.

What is the molecular formula of N1-(4-Aminobutyl)-1,4-butanediamine?

The molecular formula of N1-(4-Aminobutyl)-1,4-butanediamine is C8H21N3.

What is the molecular weight of N1-(4-Aminobutyl)-1,4-butanediamine?

The molecular weight of N1-(4-Aminobutyl)-1,4-butanediamine is 159.17355 g/mol.

What are the applications of N1-(4-Aminobutyl)-1,4-butanediamine?

N1-(4-Aminobutyl)-1,4-butanediamine is used in polymer chemistry and functional materials synthesis, as well as lubricant and fuel additive formulations. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies N1-(4-Aminobutyl)-1,4-butanediamine (CAS 4427-76-3)...

Where can I buy N1-(4-Aminobutyl)-1,4-butanediamine?

You can request a quote for N1-(4-Aminobutyl)-1,4-butanediamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for N1-(4-Aminobutyl)-1,4-butanediamine?

Yes, CoreyChem provides custom synthesis services for N1-(4-Aminobutyl)-1,4-butanediamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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