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2-(3-Aminopropanoylamino)-4-methylpentanoic acid structure
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2-(3-Aminopropanoylamino)-4-methylpentanoic acid

TL;DR: 2-(3-Aminopropanoylamino)-4-methylpentanoic acid (CAS 102029-56-1) is a chemical compound with molecular formula C9H18N2O3 and molecular weight 202.13174 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-(3-aminopropanoylamino)-4-methylpentanoic acid

Also Known As: alanyl-DL-leucine, beta-ALA-LEU, H-BETA-ALA-DL-LEU-OH, b-alanyl-dl-leucine, Beta-alanyl-dl-leucine

CAS Number
102029-56-1
Molecular Formula
C9H18N2O3
Molecular Weight
202.13174 g/mol
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Application Areas

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

Heterocyclic Building Blocks (6 patents) Organic Building Blocks (10 patents) Pharmaceutical Intermediates (15 patents)

Technical Specifications

Molecular FormulaC9H18N2O3
Molecular Weight202.13174 g/mol
XLogP-2.4
Topological Polar Surface Area (TPSA)92.4 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors4
Rotatable Bonds6
Exact Mass202.13174 Da
Heavy Atoms14
Complexity204.0
SMILESCC(C)CC(C(=O)O)NC(=O)CCN
InChIKeyYVFFCSSMTOXAQS-UHFFFAOYSA-N

Chemical Property Profile of 2-(3-Aminopropanoylamino)-4-methylpentanoic acid

XLogP
-2.4
TPSA (Topological Polar Surface Area)
92.4
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
4
Rotatable Bonds
6
Heavy Atoms
14
Complexity
204.0
Exact Mass
202.13174
Monoisotopic Mass
202.13174
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 2-(3-Aminopropanoylamino)-4-methylpentanoic acid

The XLogP value of -2.4 indicates that 2-(3-Aminopropanoylamino)-4-methylpentanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 92.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-Aminopropanoylamino)-4-methylpentanoic acid. Following Lipinski's Rule of Five, 2-(3-Aminopropanoylamino)-4-methylpentanoic 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 2-(3-Aminopropanoylamino)-4-methylpentanoic acid?

The CAS number of 2-(3-Aminopropanoylamino)-4-methylpentanoic acid is 102029-56-1.

What is the molecular formula of 2-(3-Aminopropanoylamino)-4-methylpentanoic acid?

The molecular formula of 2-(3-Aminopropanoylamino)-4-methylpentanoic acid is C9H18N2O3.

What is the molecular weight of 2-(3-Aminopropanoylamino)-4-methylpentanoic acid?

The molecular weight of 2-(3-Aminopropanoylamino)-4-methylpentanoic acid is 202.13174 g/mol.

Where can I buy 2-(3-Aminopropanoylamino)-4-methylpentanoic acid?

You can request a quote for 2-(3-Aminopropanoylamino)-4-methylpentanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-(3-Aminopropanoylamino)-4-methylpentanoic acid?

Yes, CoreyChem provides custom synthesis services for 2-(3-Aminopropanoylamino)-4-methylpentanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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