Boc-Ala-Ala-OH - ≥97% , CAS No.27317-69-7

CAS: 27317-69-7 Cat. No.: B483846 Formula: C₁₁H₂₀N₂O₅ Peso molecolare: 260.29

GRADE & PURITY ≥97%

Synonyms

N-tert-butyloxycarbonyl-L-alanyl-L-alanine | s12086 | HY-W039756 | BZNDDHWTEVCBAD-BQBZGAKWSA-N | L-Alanine, N-[(1,1-dimethylethoxy)carbonyl]-L-alanyl- | BOC-ALA-ALA-OH | B6187 | (tert-Butoxycarbonyl)-L-alanyl-L-alanine | MFCD00038564 | DTXSID40950035 | NS

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Sinonimi

N-tert-butyloxycarbonyl-L-alanyl-L-alanine | s12086 | HY-W039756 | BZNDDHWTEVCBAD-BQBZGAKWSA-N | L-Alanine, N-[(1,1-dimethylethoxy)carbonyl]-L-alanyl- | BOC-ALA-ALA-OH | B6187 | (tert-Butoxycarbonyl)-L-alanyl-L-alanine | MFCD00038564 | DTXSID40950035 | NS

Specifiche e purezza

≥97%

Condizioni di conservazione di stoccaggio

Store at 2-8°C,Argon charged

Spedito in

Wet ice

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Purezza

≥97%

Proprietà del prodotto

• pKa: pKa: 3.52

Nomi e identificatori

• Pubchem Sid: 504764433
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504764433
• Sorrisi canonici: CC(C(=O)NC(C)C(=O)O)NC(=O)OC(C)(C)C
• IUPAC Name: (2S)-2-[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]propanoic acid
• InChIKey: BZNDDHWTEVCBAD-BQBZGAKWSA-N
• INCHI: 1S/C11H20N2O5/c1-6(8(14)12-7(2)9(15)16)13-10(17)18-11(3,4)5/h6-7H,1-5H3,(H,12,14)(H,13,17)(H,15,16)/t6-,7-/m0/s1
• Isomeri SMILES: C[C@@H](C(=O)N[C@@H](C)C(=O)O)NC(=O)OC(C)(C)C
• Peso molecolare: 260.29
• Reaxy-Rn: 4811300
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4811300&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Classe Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Level5 Peptides
          • Level6 Dipeptides

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Peptides
• Direct Parent: Dipeptides
• Alternative Parents: N-acyl-L-alpha-amino acids Alpha amino acid amides Alanine and derivatives Carbamate esters Secondary carboxylic acid amides Organic carbonic acids and derivatives Monocarboxylic acids and derivatives Carboxylic acids Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Alpha-dipeptide - N-acyl-l-alpha-amino acid - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Alanine or derivatives - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Carbamic acid ester - Carboxamide group - Secondary carboxylic acid amide - Carbonic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Aliphatic acyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as dipeptides. These are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Meccanismi d'azione

Proprietà chimiche e fisiche

• Indice di rifrazione: n20D1.48 (Predicted)
• Punto di fusione (°C): 119° C
• Peso molecolare: 260.290 g/mol
• XLogP3: 0.700
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 6
• Exact Mass: 260.137 Da
• Monoisotopic Mass: 260.137 Da
• Topological Polar Surface Area: 105.000 Ų
• Heavy Atom Count: 18
• Formal Charge: 0
• Complexity: 335.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 2
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Domande frequenti

What is the purity of this product?

This product is supplied at ≥97% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 27317-69-7, the molecular formula is C11H20N2O5, and the molecular weight is 260.29 g/mol. InChIKey BZNDDHWTEVCBAD-BQBZGAKWSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.