Fmoc-Met-OPfp - ≥96% , CAS No.86060-94-8

CAS: 86060-94-8 Cat. No.: F116839 Peso molecular: 537.5 Beilstein Registry Number: 4732241 Número EC: 685-328-8 PubChem CID: 13585949

GRADE & PURITY ≥96%

Synonyms

F11066 | 2,3,4,5,6-pentafluorophenyl (2S)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-4-(methylsulfanyl)butanoate | N-alpha-(9-Fluorenylmethyloxycarbonyl)-L-methionine pentafluorphenyl ester (Fmoc-L-Met-OPfp) | A863324 | MFCD00065665 | Fmoc-Met-OPfp, >=

Storage

Conservar a 2-8°C

Shipped In

Hielo húmedo

Specifications

Sinónimos

F11066 | 2, 3, 4, 5, 6-pentafluorophenyl (2S)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-4-(methylsulfanyl)butanoate | N-alpha-(9-Fluorenylmethyloxycarbonyl)-L-methionine pentafluorphenyl ester (Fmoc-L-Met-OPfp) | A863324 | MFCD00065665 | Fmoc-Met-OPfp, >=

Especificaciones y pureza

≥96%

Condiciones de almacenamiento de almacenamiento

Conservar a 2-8°C

Enviado en

Hielo húmedo

Pureza

≥96%

Nombres e identificadores

• Pubchem Sid: 504767447
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504767447
• Sonrisas canónicas: CSCCC(C(=O)OC1=C(C(=C(C(=C1F)F)F)F)F)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
• IUPAC Name: (2,3,4,5,6-pentafluorophenyl) (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylsulfanylbutanoate
• InChIKey: OKDPSRDTLNXPFQ-SFHVURJKSA-N
• INCHI: 1S/C26H20F5NO4S/c1-37-11-10-18(25(33)36-24-22(30)20(28)19(27)21(29)23(24)31)32-26(34)35-12-17-15-8-4-2-6-13(15)14-7-3-5-9-16(14)17/h2-9,17-18H,10-12H2,1H3,(H,32,34)/t18-/m0/s1
• Isómeros SMILES: CSCC[C@@H](C(=O)OC1=C(C(=C(C(=C1F)F)F)F)F)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
• WGK Alemania: 3
• PubChem CID: 13585949
• Peso molecular: 537.5
• Beilstein: 4732241

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 Methionine 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: Methionine and derivatives
• Alternative Parents: Alpha amino acid esters Fluorenes Phenol esters Phenoxy compounds Fatty acid esters Fluorobenzenes Aryl fluorides Carbamate esters Carboxylic acid esters Monocarboxylic acids and derivatives Dialkylthioethers Sulfenyl compounds Organic oxides Carbonyl compounds Organofluorides Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Methionine or derivatives - Alpha-amino acid ester - Fluorene - Phenol ester - Phenoxy compound - Fatty acid ester - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Carbamic acid ester - Carboxylic acid ester - Dialkylthioether - Sulfenyl compound - Thioether - Monocarboxylic acid or derivatives - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organofluoride - Organonitrogen compound - Aromatic homopolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as methionine and derivatives. These are compounds containing methionine or a derivative thereof resulting from reaction of methionine 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

• Peso molecular: 537.500 g/mol
• XLogP3: 6.100
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 10
• Exact Mass: 537.103 Da
• Monoisotopic Mass: 537.103 Da
• Topological Polar Surface Area: 89.900 Ų
• Heavy Atom Count: 37
• Formal Charge: 0
• Complexity: 758.000
• 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