Boc-L-prolinal - ≥97% , CAS No.69610-41-9

CAS: 69610-41-9 Cat. No.: B102428 Fórmula: C₁₀H₁₇NO₃ Peso molecular: 199.25 Número CE: 627-548-9

GRADE & PURITY ≥97%

Synonyms

n-boc-(s)-prolinal | AKOS015841252 | tert-butyl (25)-2-formylpyrrolidine-1-carboxylate | A9208 | AKOS005146339 | (2S)-1-(tert-Butoxycarbonyl)pyrrolidine-2-carbaldehyde | MFCD00801206 | t-butoxycarbonyl-L-prolinal | (S)-1-Boc-2-Formylpyrrolidine | N-Boc-L-

Storage

Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Visão geral

Boc-L-Prolinal is a proline with a Boc protecting group, which can be used to synthesize biologically active peptide mimetics.

Specifications

Sinónimos

n-boc-(s)-prolinal | AKOS015841252 | tert-butyl (25)-2-formylpyrrolidine-1-carboxylate | A9208 | AKOS005146339 | (2S)-1-(tert-Butoxycarbonyl)pyrrolidine-2-carbaldehyde | MFCD00801206 | t-butoxycarbonyl-L-prolinal | (S)-1-Boc-2-Formylpyrrolidine | N-Boc-L-

Especificações e pureza

≥97%

Condições de armazenamento de armazenamento

Store at -20°C,Argon charged

Enviado em

Ice chest + Ice pads

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Pureza

≥97%

Nomes e identificadores

• Pubchem Sid: 504761181
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504761181
• Sorrisos canónicos: CC(C)(C)OC(=O)N1CCCC1C=O
• IUPAC Name: tert-butyl (2S)-2-formylpyrrolidine-1-carboxylate
• InChIKey: YDBPZCVWPFMBDH-QMMMGPOBSA-N
• INCHI: 1S/C10H17NO3/c1-10(2,3)14-9(13)11-6-4-5-8(11)7-12/h7-8H,4-6H2,1-3H3/t8-/m0/s1
• SMILES isoméricas: CC(C)(C)OC(=O)N1CCC[C@H]1C=O
• WGK Alemanha: 3
• Peso molecular: 199.25
• Reaxy-Rn: 1456830
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1456830&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Pyrrolidines
      • Subclass Pyrrolidine carboxylic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Pyrrolidines
• Subclass: Pyrrolidine carboxylic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyrrolidine carboxylic acids
• Alternative Parents: Carbamate esters Organic carbonic acids and derivatives Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Aldehydes
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Pyrrolidine carboxylic acid - Carbamic acid ester - Carbonic acid derivative - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aldehyde - Aliphatic heteromonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as pyrrolidine carboxylic acids. These are compounds containing a pyrrolidine ring which bears a carboxylic acid. Pyrrolidine is a five-membered saturated aliphatic heterocycle with one nitrogen atom and four carbon atoms.
• 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

Propriedades químicas e físicas

• Solubilidade: Slightly soluble water. Soluble in chloroform
• Sensibilidade: air sensitive ；heat sensitive
• Índice de refração: 1.462
• Ponto de inflamação (°F): 134.6 °F
• Ponto de inflamação (°C): >110°C
• Ponto de ebulição (°C): 211°C
• Peso molecular: 199.250 g/mol
• XLogP3: 1.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 199.121 Da
• Monoisotopic Mass: 199.121 Da
• Topological Polar Surface Area: 46.600 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 232.000
• 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