4-Chloroindole - ≥98% , CAS No.25235-85-2

CAS: 25235-85-2 Cat. No.: C107955 Formula: C₈H₆ClN Peso molecolare: 151.59 Beilstein Registry Number: 114880 Numero EC: 246-747-8

GRADE & PURITY ≥98%

Synonyms

AB00468 | 2,6-Bis[(4R)-phenyl-2-(oxazolin-2-yl)]pyridine | A807108 | FT-0664732 | SVLZRCRXNHITBY-UHFFFAOYSA- | SY005775 | BCP26897 | 4-Chloro-1H-indole # | 1H-Indole, 4-chloro- | Indole, 4-chloro- | 1H-Indole,4-chloro;4-Chloro-1H-indole | 4-Chloroindole |

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Panoramica

The nitrosation rate of 4-chloroindole and the stability of its nitrosated products were studied.
An indole derivative which acts as an inhibitor.

Specifications

Sinonimi

AB00468 | 2,6-Bis[(4R)-phenyl-2-(oxazolin-2-yl)]pyridine | A807108 | FT-0664732 | SVLZRCRXNHITBY-UHFFFAOYSA- | SY005775 | BCP26897 | 4-Chloro-1H-indole # | 1H-Indole, 4-chloro- | Indole, 4-chloro- | 1H-Indole,4-chloro;4-Chloro-1H-indole | 4-Chloroindole |

Specifiche e purezza

≥98%

Condizioni di conservazione di stoccaggio

Store at 2-8°C,Argon charged

Spedito in

Wet ice

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

Purezza

≥98%

Nomi e identificatori

• Pubchem Sid: 488186648
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488186648
• Sorrisi canonici: C1=CC2=C(C=CN2)C(=C1)Cl
• IUPAC Name: 4-chloro-1H-indole
• InChIKey: SVLZRCRXNHITBY-UHFFFAOYSA-N
• INCHI: 1S/C8H6ClN/c9-7-2-1-3-8-6(7)4-5-10-8/h1-5,10H
• Isomeri SMILES: C1=CC2=C(C=CN2)C(=C1)Cl
• WGK Germania: 3
• Peso molecolare: 151.59
• Beilstein: 114880
• Reaxy-Rn: 114880
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=114880&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Indoles and derivatives
      • Subclass Indoles

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Indoles and derivatives
• Subclass: Indoles
• Intermediate Tree Nodes: Not available
• Direct Parent: Indoles
• Alternative Parents: Benzenoids Aryl chlorides Pyrroles Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Indole - Benzenoid - Aryl halide - Aryl chloride - Heteroaromatic compound - Pyrrole - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as indoles. These are compounds containing an indole moiety, which consists of pyrrole ring fused to benzene to form 2,3-benzopyrrole.
• 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

• Solubilità: Soluble in Chloroform and Methanol
• Sensibilità: Light & Air sensitive
• Indice di rifrazione: 1.628
• Punto di infiammabilità (°F): 235.4 °F
• Punto di infiammabilità (°C): 113 °C
• Punto di ebollizione (°C): 129-130°C
• Peso molecolare: 151.590 g/mol
• XLogP3: 3.400
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 151.019 Da
• Monoisotopic Mass: 151.019 Da
• Topological Polar Surface Area: 15.800 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 126.000
• 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?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships chilled on wet ice. 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 25235-85-2, the molecular formula is C8H6ClN, and the molecular weight is 151.59 g/mol. InChIKey SVLZRCRXNHITBY-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.