Benzyl azide - ≥90% , CAS No.622-79-7

CAS: 622-79-7 Cat. No.: B189174 분자식: C₇H₇N₃ 분자량: 133.15 EC 번호: 680-691-9

GRADE & PURITY ≥90%

Synonyms

Bn-N3 | NSC26304 | NSC-26304 | TOLUENE, alpha-AZIDO- | UNII-HFD57Z7J9J | HFD57Z7J9J | (azidomethyl) benzene | CCRIS 8029 | doi:10.14272/UDLLFLQFQMACJB-UHFFFAOYSA-N.1 | EN300-82312 | (Azidomethyl)benzene, Pract. | Benzyl azide | F1905-6985 | AMY19781 | 10.

Storage

Store at 2-8°C

Shipped In

Wet ice

개요

Product Introduction

Benzyl azide is an aromatic azide, commonly used in copper (I) catalyzed azide-alkyne cycloaddition reaction.

Product Application
Benzyl azide is used in the synthesis of 1,2,3-triazole derivatives. It serves as a reagent used to introduce a PhCH2N group into a molecule.

Specifications

동의어

Bn-N3 | NSC26304 | NSC-26304 | TOLUENE, alpha-AZIDO- | UNII-HFD57Z7J9J | HFD57Z7J9J | (azidomethyl) benzene | CCRIS 8029 | doi:10.14272/UDLLFLQFQMACJB-UHFFFAOYSA-N.1 | EN300-82312 | (Azidomethyl)benzene, Pract. | Benzyl azide | F1905-6985 | AMY19781 | 10.

사양 및 순도

≥90%

보관 조건

Store at 2-8°C

배송

Wet ice

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순수함

≥90%

이름과 식별자

Pubchem Sid

504752270

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504752270

정식 스마일

C1=CC=C(C=C1)CN=[N+]=[N-]

IUPAC Name

azidomethylbenzene

InChIKey

UDLLFLQFQMACJB-UHFFFAOYSA-N

INCHI

1S/C7H7N3/c8-10-9-6-7-4-2-1-3-5-7/h1-5H,6H2

이성체 SMILES

C1=CC=C(C=C1)CN=[N+]=[N-]

분자량

133.15

Reaxy-Rn

636825

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=636825&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • 분류 Benzene and substituted derivatives

• Kingdom: Organic compounds
• Superclass: Benzenoids
• 분류: Benzene and substituted derivatives
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzene and substituted derivatives
• Alternative Parents: Azo imides Azo compounds Organic salts Hydrocarbon derivatives Organic cations
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Monocyclic benzene moiety - Azo imide - Azo compound - Organic nitrogen compound - Hydrocarbon derivative - Organic salt - Organonitrogen compound - Organic cation - Aromatic homomonocyclic compound
• 설명: This compound belongs to the class of organic compounds known as benzene and substituted derivatives. These are aromatic compounds containing one monocyclic ring system consisting of benzene.
• 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

관련 대상(인간)

SIRT2 Tchem NAD-dependent deacetylase sirtuin 2 (3979 Activities)

Discover Target: SIRT2

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

작용 메커니즘

화학 및 물리적 특성

• 용해성: Insoluble in waterMiscible with ethanol and diethyl ether. Immiscible with water
• 감도: light sensitive
• 굴절률: 1.5341
• 발화점(°F): 110°F
• 발화점(°C): 43°C
• 끓는점(°C): 82-85°/16mm
• 분자량: 133.150 g/mol
• XLogP3: 2.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 133.064 Da
• Monoisotopic Mass: 133.064 Da
• Topological Polar Surface Area: 14.400 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 132.000
• 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