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hexa-L-alanine structure
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hexa-L-alanine

TL;DR: hexa-L-alanine (CAS 111652-29-0) is a chemical compound with molecular formula C18H32N6O7 and molecular weight 444.23325 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[2-[2-[2-[2-(2-aminopropanoylamino)propanoylamino]propanoylamino]propanoylamino]propanoylamino]propanoic acid

Also Known As: hexa-L-alanine, 17-Amino-2,5,8,11,14-pentamethyl-4,7,10,13,16-pentaoxo-3,6,9,12,15-pentaazaoctadecan-1-oic acid, 2-[2-[2-[2-[2-(2-aminopropanoylamino)propanoylamino]propanoylamino]propanoylamino]propanoylamino]propanoic acid, (2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]propanoyl]amino]propanoyl]amino]propanoyl]amino]propanoyl]amino]propanoic acid, L-Alanine,N-[N-[N-[N-(N-L-alanyl-L-alanyl)-L-alanyl]-L-alanyl]-L-alanyl]-,monohydrochloride (9CI)

CAS Number
111652-29-0
Molecular Formula
C18H32N6O7
Molecular Weight
444.23325 g/mol
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Application Areas

Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.

Biotechnology (11 patents) Food Additives (2 patents)

Technical Specifications

Molecular FormulaC18H32N6O7
Molecular Weight444.23325 g/mol
XLogP-4.3
Topological Polar Surface Area (TPSA)209.0 Ų
Hydrogen Bond Donors7
Hydrogen Bond Acceptors8
Rotatable Bonds11
Exact Mass444.23325 Da
Heavy Atoms31
Complexity714.0
SMILESCC(C(=O)NC(C)C(=O)NC(C)C(=O)NC(C)C(=O)NC(C)C(=O)NC(C)C(=O)O)N
InChIKeyZLHDFPIXRRJBKM-UHFFFAOYSA-N

Chemical Property Profile of hexa-L-alanine

XLogP
-4.3
TPSA (Topological Polar Surface Area)
209.0
Hydrogen Bond Donors
7
Hydrogen Bond Acceptors
8
Rotatable Bonds
11
Heavy Atoms
31
Complexity
714.0
Exact Mass
444.23325
Monoisotopic Mass
444.23325
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 hexa-L-alanine

The XLogP value of -4.3 indicates that hexa-L-alanine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 209.0 Ų indicates high polarity, suggesting hexa-L-alanine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, hexa-L-alanine has 7 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of hexa-L-alanine?

The CAS number of hexa-L-alanine is 111652-29-0.

What is the molecular formula of hexa-L-alanine?

The molecular formula of hexa-L-alanine is C18H32N6O7.

What is the molecular weight of hexa-L-alanine?

The molecular weight of hexa-L-alanine is 444.23325 g/mol.

Where can I buy hexa-L-alanine?

You can request a quote for hexa-L-alanine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for hexa-L-alanine?

Yes, CoreyChem provides custom synthesis services for hexa-L-alanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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