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n-Hexanoyl-dl-leucine structure
Fine Chemical

n-Hexanoyl-dl-leucine

TL;DR: n-Hexanoyl-dl-leucine (CAS 133906-92-0) is a chemical compound with molecular formula C12H23NO3 and molecular weight 229.1678 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-(hexanoylamino)-4-methylpentanoic acid

Also Known As: n-Hexanoylleucine, n-Hexanoylleucine #, n-Hexanoyl-dl-leucine, Leucine, N-(1-oxohexyl)-, 2-(hexanoylamino)-4-methylpentanoic acid

CAS Number
133906-92-0
Molecular Formula
C12H23NO3
Molecular Weight
229.1678 g/mol
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Application Areas

Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.

Biotechnology (1 patents) Pharmaceutical Intermediates (4 patents) Surfactants & Detergents (1 patents)

Technical Specifications

Molecular FormulaC12H23NO3
Molecular Weight229.1678 g/mol
XLogP2.8
Topological Polar Surface Area (TPSA)66.4 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors3
Rotatable Bonds8
Exact Mass229.1678 Da
Heavy Atoms16
Complexity226.0
SMILESCCCCCC(=O)NC(CC(C)C)C(=O)O
InChIKeyAGYKPEGQFMCGNK-UHFFFAOYSA-N

Product Description

Applications: n-Hexanoyl-dl-leucine is used in pharmaceutical synthesis routes and API production, as well as surfactant and detergent formulations. 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).

A pharmaceutical intermediate supplied by CoreyChem, n-Hexanoyl-dl-leucine (CAS 133906-92-0) has the molecular formula C12H23NO3 and a molecular weight of 229.17 g/mol. Synonyms include n-Hexanoylleucine and n-Hexanoylleucine #.

Custom synthesis (mg to ton scale), HPLC/NMR/MS analytical support, and complete COA/MSDS documentation are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of n-Hexanoyl-dl-leucine

XLogP
2.8
TPSA (Topological Polar Surface Area)
66.4
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
3
Rotatable Bonds
8
Heavy Atoms
16
Complexity
226.0
Exact Mass
229.1678
Monoisotopic Mass
229.1678
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 n-Hexanoyl-dl-leucine

The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for n-Hexanoyl-dl-leucine. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for n-Hexanoyl-dl-leucine. Following Lipinski's Rule of Five, n-Hexanoyl-dl-leucine has 2 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 n-Hexanoyl-dl-leucine?

The CAS number of n-Hexanoyl-dl-leucine is 133906-92-0.

What is the molecular formula of n-Hexanoyl-dl-leucine?

The molecular formula of n-Hexanoyl-dl-leucine is C12H23NO3.

What is the molecular weight of n-Hexanoyl-dl-leucine?

The molecular weight of n-Hexanoyl-dl-leucine is 229.1678 g/mol.

What are the applications of n-Hexanoyl-dl-leucine?

n-Hexanoyl-dl-leucine is used in pharmaceutical synthesis routes and API production, as well as surfactant and detergent formulations. 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...

Where can I buy n-Hexanoyl-dl-leucine?

You can request a quote for n-Hexanoyl-dl-leucine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for n-Hexanoyl-dl-leucine?

Yes, CoreyChem provides custom synthesis services for n-Hexanoyl-dl-leucine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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