Dibenzyl azodicarboxylate - ≥94%, used for Dibenzyl azodicarboxylate was used as electrophilic reagent in the synthesis of C-glycosyl α-amino acids via proline-catalyzed α-amination of C-glycosylalkyl aldehydes. It was used in enantioselective synthesis o

CAS: 2449-05-0 Cat. No.: D113409 分子式: C₁₆H₁₄N₂O₄ 分子量: 298.29 Beilstein Registry Number: 2298734 EC番号: 219-508-0

GRADE & PURITY ≥94%

Synonyms

AKOS024348901 | NCI60_006088 | Q27285524 | Dibenzyl azodicarboxylate | benzyl N-phenylmethoxycarbonyliminocarbamate | FT-0624649 | IRJKSAIGIYODAN-UHFFFAOYSA-N | DTXSID3044887 | IRJKSAIGIYODAN-ISLYRVAYSA-N | C93451 | Dibenzyl (E)-1,2-diazenedicarboxylate |

Storage

Store at 2-8°C

Shipped In

Wet ice

概要

Dibenzyl azodicarboxylate undergoes[4+2] cycloaddition reaction with glycal to yield 2-aminoglycosides.

Specifications

同義語

AKOS024348901 | NCI60_006088 | Q27285524 | Dibenzyl azodicarboxylate | benzyl N-phenylmethoxycarbonyliminocarbamate | FT-0624649 | IRJKSAIGIYODAN-UHFFFAOYSA-N | DTXSID3044887 | IRJKSAIGIYODAN-ISLYRVAYSA-N | C93451 | Dibenzyl (E)-1,2-diazenedicarboxylate |

仕様と純度

≥94%

申し込み

Dibenzyl azodicarboxylate was used as electrophilic reagent in the synthesis of C-glycosyl α-amino acids via proline-catalyzed α-amination of C-glycosylalkyl aldehydes. It was used in enantioselective synthesis of optically active pyrazolidine derivatives

保管条件

Store at 2-8°C

入荷

Wet ice

この製品は冷冷この冷このこの製品の運送が必要です。地上およびその他の経済サービスは利用できません。

純度

≥94%

名前と識別子

パブケム・シド

504754962

パブケム・シド・ウル

https://pubchem.ncbi.nlm.nih.gov/substance/504754962

カノニカル・スマイル

C1=CC=C(C=C1)COC(=O)N=NC(=O)OCC2=CC=CC=C2

IUPAC Name

benzyl N-phenylmethoxycarbonyliminocarbamate

InChIKey

IRJKSAIGIYODAN-UHFFFAOYSA-N

INCHI

1S/C16H14N2O4/c19-15(21-11-13-7-3-1-4-8-13)17-18-16(20)22-12-14-9-5-2-6-10-14/h1-10H,11-12H2

異性体SMILES

C1=CC=C(C=C1)COC(=O)N=NC(=O)OCC2=CC=CC=C2

WGKドイツ

3

分子量

298.29

Beilstein

2298734

Reaxy-Rn

2298734

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2298734&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • 分類 Benzene and substituted derivatives
      • Subclass Benzyloxycarbonyls

• Kingdom: Organic compounds
• Superclass: Benzenoids
• 分類: Benzene and substituted derivatives
• Subclass: Benzyloxycarbonyls
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzyloxycarbonyls
• Alternative Parents: Organic carbonic acids and derivatives Azo compounds Propargyl-type 1,3-dipolar organic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Benzyloxycarbonyl - Carbonic acid derivative - Azo compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aromatic homomonocyclic compound
• 説明: This compound belongs to the class of organic compounds known as benzyloxycarbonyls. These are organic compounds containing a carbonyl group substituted with a benzyloxyl group.
• 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

化学的性質と物理的性質

• 融点（°C）: 44°C-46°C
• 分子量: 298.290 g/mol
• XLogP3: 3.900
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 298.095 Da
• Monoisotopic Mass: 298.095 Da
• Topological Polar Surface Area: 77.300 Ų
• Heavy Atom Count: 22
• Formal Charge: 0
• Complexity: 350.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 1
• The total count of all stereochemical bonds: 1
• Covalently-Bonded Unit Count: 1