1-Azido-4-chlorobenzene solution - ≥95%(HPLC), ~0.5M in tert-butyl methyl ether , CAS No.3296-05-7

CAS: 3296-05-7 Cat. No.: A462935 Formula: C₆H₄ClN₃ Peso molecolare: 153.57 Beilstein Registry Number: 1210408 Numero EC: 685-976-1

GRADE & PURITY ≥95%(HPLC), ~0.5M in tert-butyl methyl ether

Synonyms

p-Chloro -Azido-benzene | J-018950 | p-chlorophenyl azide | 4-Chlorophenyl azide | 4-Chlorophenylazide | BB 0257675 | BS-13268 | 1-Azido-4-chlorobenzene 0.5M in tert-butyl methyl ether | SCHEMBL13653944 | F2157-0478 | AKOS009325427 | MFCD00869580 | 1-Azid

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Specifications

Sinonimi

p-Chloro -Azido-benzene | J-018950 | p-chlorophenyl azide | 4-Chlorophenyl azide | 4-Chlorophenylazide | BB 0257675 | BS-13268 | 1-Azido-4-chlorobenzene 0.5M in tert-butyl methyl ether | SCHEMBL13653944 | F2157-0478 | AKOS009325427 | MFCD00869580 | 1-Azid

Specifiche e purezza

≥95%(HPLC), ~0.5M in tert-butyl methyl ether

Condizioni di conservazione di stoccaggio

Store at -20°C

Spedito in

Ice chest + Ice pads

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Purezza

≥95%(HPLC)

Nomi e identificatori

Sorrisi canonici

C1=CC(=CC=C1N=[N+]=[N-])Cl

IUPAC Name

1-azido-4-chlorobenzene

InChIKey

HZVGOEUGZJFTNN-UHFFFAOYSA-N

INCHI

1S/C6H4ClN3/c7-5-1-3-6(4-2-5)9-10-8/h1-4H

Isomeri SMILES

C1=CC(=CC=C1N=[N+]=[N-])Cl

WGK Germania

3

Peso molecolare

153.57

Beilstein

1210408

Reaxy-Rn

1210408

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1210408&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Benzene and substituted derivatives
      • Subclass Phenylazides

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Phenylazides
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylazides
• Alternative Parents: Chlorobenzenes Aryl chlorides Azo imides Azo compounds Organopnictogen compounds Organochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Phenylazide - Halobenzene - Chlorobenzene - Aryl halide - Aryl chloride - Azo imide - Azo compound - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic homomonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as phenylazides. These are compounds containing a phenylazide moiety, which consists of a linear azide substituent attached to a phenyl 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

Proprietà chimiche e fisiche

• Punto di ebollizione (°C): 419.33 °C (Predicted)
• Punto di fusione (°C): 20 °C
• Peso molecolare: 153.570 g/mol
• XLogP3: 3.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 153.009 Da
• Monoisotopic Mass: 153.009 Da
• Topological Polar Surface Area: 14.400 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 145.000
• 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

Domande frequenti

What is the purity of this product, and how is it determined?

This product is supplied at ≥95% purity, determined by HPLC. Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at ?20 °C. Freezer storage is required to maintain the specified shelf life.

How is this product shipped?

This product ships in an insulated container with ice pads. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 3296-05-7, the molecular formula is C6H4ClN3, and the molecular weight is 153.57 g/mol. InChIKey HZVGOEUGZJFTNN-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.