Fmoc-N-metil-L-leucina - Moligand™,≥99% , CAS No.103478-62-2

CAS: 103478-62-2 Cat. No.: F117114 Peso molecular: 367.44 Beilstein Registry Number: 3630430 Número EC: 689-222-2

GRADE & PURITY Moligand™, ≥99%

Synonyms

DTXSID7064150 | AKOS015837125 | Ácido (S)-2-((((9H-fluoren-9-il)metoxi)carbonil)(metil)amino)-4-metilpentanoico | HY-W008558 | A800747 | FMOC-MeLeu-OH | Fmoc-N-Me-Leu-OH | MH-0721 | SCHEMBL451481 | SCHEMBL1486163 | EN300-1268400 | DS-0784 | Fmoc-N-metil

Storage

Conservar a 2-8°C

Shipped In

Hielo húmedo

Specifications

Sinónimos

DTXSID7064150 | AKOS015837125 | Ácido (S)-2-((((9H-fluoren-9-il)metoxi)carbonil)(metil)amino)-4-metilpentanoico | HY-W008558 | A800747 | FMOC-MeLeu-OH | Fmoc-N-Me-Leu-OH | MH-0721 | SCHEMBL451481 | SCHEMBL1486163 | EN300-1268400 | DS-0784 | Fmoc-N-metil

Especificaciones y pureza

Moligand™, ≥99%

Condiciones de almacenamiento de almacenamiento

Conservar a 2-8°C

Enviado en

Hielo húmedo

Grado

Moligand™

Pureza

≥99%

Nombres e identificadores

• Pubchem Sid: 504764547
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504764547
• Sonrisas canónicas: CC(C)CC(C(=O)O)N(C)C(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13
• IUPAC Name: (2S)-2-[9H-fluoren-9-ylmethoxycarbonyl(methyl)amino]-4-methylpentanoic acid
• InChIKey: BUJQSIPFDWLNDC-FQEVSTJZSA-N
• INCHI: 1S/C22H25NO4/c1-14(2)12-20(21(24)25)23(3)22(26)27-13-19-17-10-6-4-8-15(17)16-9-5-7-11-18(16)19/h4-11,14,19-20H,12-13H2,1-3H3,(H,24,25)/t20-/m0/s1
• Isómeros SMILES: CC(C)C[C@@H](C(=O)O)N(C)C(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13
• WGK Alemania: 3
• Peso molecular: 367.44
• Beilstein: 3630430
• Reaxy-Rn: 40603928
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=40603928&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Clase Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Level5 Amino acids and derivatives
          • Level6 Alpha amino acids and derivatives
            • Level7 Leucine and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Clase: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Amino acids and derivatives - Alpha amino acids and derivatives
• Direct Parent: Leucine and derivatives
• Alternative Parents: Fluorenes Carbamate esters Monocarboxylic acids and derivatives Carboxylic acids Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Leucine or derivatives - Fluorene - Benzenoid - Carbamic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aromatic homopolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as leucine and derivatives. These are compounds containing leucine or a derivative thereof resulting from reaction of leucine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
• 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

Propiedades químicas y físicas

• Rotación específica [α]: -20° (C=1,DMF)
• Punto de fusión (°C): 113-116°C
• Peso molecular: 367.400 g/mol
• XLogP3: 4.600
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 367.178 Da
• Monoisotopic Mass: 367.178 Da
• Topological Polar Surface Area: 66.800 Ų
• Heavy Atom Count: 27
• Formal Charge: 0
• Complexity: 512.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 1
• 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