Boc-Sar-OH - ≥98% , CAS No.13734-36-6

CAS: 13734-36-6 Cat. No.: S118251 Fórmula: C₈H₁₅NO₄ Peso molecular: 189.21 Beilstein Registry Number: 2046827 Número CE: 237-306-0 PubChem CID: 83692

GRADE & PURITY ≥98%

Synonyms

N-(tert-butoxycarbonyl)-N-methylglycine | Boc-sarcosine | N-t-Boc-sarcosine | N-Boc-sarcosine | t-Boc-sarcosine | Boc-N-methylglycine | Glycine, N-[(1,1-dimethylethoxy)carbonyl]-N-methyl- | Boc-Sar-OH | N-Boc-N-Methylglycine | N-α-t.-Boc-sarcosine

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Sinónimos

N-(tert-butoxycarbonyl)-N-methylglycine | Boc-sarcosine | N-t-Boc-sarcosine | N-Boc-sarcosine | t-Boc-sarcosine | Boc-N-methylglycine | Glycine, N-[(1,1-dimethylethoxy)carbonyl]-N-methyl- | Boc-Sar-OH | N-Boc-N-Methylglycine | N-α-t.-Boc-sarcosine

Especificações e pureza

≥98%

Condições de armazenamento de armazenamento

Store at 2-8°C,Argon charged

Enviado em

Wet ice

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

Pureza

≥98%

Nomes e identificadores

Pubchem Sid

504755700

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504755700

Sorrisos canónicos

CC(C)(C)OC(=O)N(C)CC(=O)O

IUPAC Name

2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]acetic acid

InChIKey

YRXIMPFOTQVOHG-UHFFFAOYSA-N

INCHI

1S/C8H15NO4/c1-8(2,3)13-7(12)9(4)5-6(10)11/h5H2,1-4H3,(H,10,11)

SMILES isoméricas

CC(C)(C)OC(=O)N(C)CC(=O)O

WGK Alemanha

3

PubChem CID

83692

Peso molecular

189.21

Beilstein

2046827

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Amino acids and derivatives
• Direct Parent: Alpha amino acids and derivatives
• Alternative Parents: Carbamate esters 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-amino acid or derivatives - Carbamic acid ester - Carbonic acid derivative - Monocarboxylic acid or derivatives - Carboxylic acid - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aliphatic acyclic compound
• Descrição: This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.
• 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

• Sensibilidade: heat & air sensitive
• Ponto de fusão (°C): 88-90°C
• Peso molecular: 189.210 g/mol
• XLogP3: 0.700
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 189.1 Da
• Monoisotopic Mass: 189.1 Da
• Topological Polar Surface Area: 66.800 Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 207.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• 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