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3,6-Diaminohexanoic acid structure
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3,6-Diaminohexanoic acid

TL;DR: 3,6-Diaminohexanoic acid (CAS 4299-56-3) is a chemical compound with molecular formula C6H14N2O2 and molecular weight 146.10553 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3,6-diaminohexanoic acid

Also Known As: beta-lysine, 3,6-Diaminohexanoic acid, Isolysine, ss-Lysine, DL-Isolysin

CAS Number
4299-56-3
Molecular Formula
C6H14N2O2
Molecular Weight
146.10553 g/mol
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Application Areas

Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (1 patents) Biotechnology (23 patents) Heterocyclic Building Blocks (34 patents) Organic Building Blocks (6 patents) Peptides & Amino Acids (15 patents)

Technical Specifications

Molecular FormulaC6H14N2O2
Molecular Weight146.10553 g/mol
XLogP-3.7
Topological Polar Surface Area (TPSA)89.3 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors4
Rotatable Bonds5
Exact Mass146.10553 Da
Heavy Atoms10
Complexity106.0
SMILESC(CC(CC(=O)O)N)CN
InChIKeyQKEWQOJCHPFEAF-UHFFFAOYSA-N

Product Description

Applications: 3,6-Diaminohexanoic acid is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. 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).

3,6-Diaminohexanoic acid (CAS 4299-56-3) is a pharmaceutical intermediate with the molecular formula C6H14N2O2 and a molecular weight of 146.11 g/mol. Synonyms include beta-lysine and 3,6-Diaminohexanoic acid.

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 3,6-Diaminohexanoic acid

XLogP
-3.7
TPSA (Topological Polar Surface Area)
89.3
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
4
Rotatable Bonds
5
Heavy Atoms
10
Complexity
106.0
Exact Mass
146.10553
Monoisotopic Mass
146.10553
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 3,6-Diaminohexanoic acid

The XLogP value of -3.7 indicates that 3,6-Diaminohexanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 89.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,6-Diaminohexanoic acid. Following Lipinski's Rule of Five, 3,6-Diaminohexanoic acid has 3 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 3,6-Diaminohexanoic acid?

The CAS number of 3,6-Diaminohexanoic acid is 4299-56-3.

What is the molecular formula of 3,6-Diaminohexanoic acid?

The molecular formula of 3,6-Diaminohexanoic acid is C6H14N2O2.

What is the molecular weight of 3,6-Diaminohexanoic acid?

The molecular weight of 3,6-Diaminohexanoic acid is 146.10553 g/mol.

What are the applications of 3,6-Diaminohexanoic acid?

3,6-Diaminohexanoic acid is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...

Where can I buy 3,6-Diaminohexanoic acid?

You can request a quote for 3,6-Diaminohexanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 3,6-Diaminohexanoic acid?

Yes, CoreyChem provides custom synthesis services for 3,6-Diaminohexanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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