8-Bromoquinoline - ≥97% , CAS No.16567-18-3

CAS: 16567-18-3 Cat. No.: B107744 분자식: C₉H₆BrN 분자량: 208.05 EC 번호: 630-629-1

등급 & 순도 ≥97%

Synonyms

STK893373 | AKOS001476139 | Z839152792 | MFCD00191859 | Quinoline, 8-bromo- | BCP27253 | 8-Bromoquinoline | 8-Bromo-quinoline | BBL020683 | AM20070091 | DTXSID10168009 | FS-2279 | 8-Bromoquinoline, 98% | A851039 | W-205946 | 8-Bromoquinoline # | EN300-558

Storage

Store at 2-8°C,Protected from light

Shipped In

Wet ice

개요

Synthesis of 8-(dimesitylboryl)quinolone (ambiphilic molecule);Direct synthesis of 5H-pyrido[3,2,1-ij]quinolin-3-one, via palladium catalyzed coupling reaction with acrolein；Preparation of 8-(1-hydroxyethyl)quinolone

사양

동의어

STK893373 | AKOS001476139 | Z839152792 | MFCD00191859 | Quinoline, 8-bromo- | BCP27253 | 8-Bromoquinoline | 8-Bromo-quinoline | BBL020683 | AM20070091 | DTXSID10168009 | FS-2279 | 8-Bromoquinoline, 98% | A851039 | W-205946 | 8-Bromoquinoline # | EN300-558

사양 및 순도

≥97%

보관 조건

Store at 2-8°C,Protected from light

배송

Wet ice

이 제품은 콜드 체인 배송이 필요합니다.지상 및 기타 경제 서비스는 사용할 수 없습니다.

순수함

≥97%

이름과 식별자

Pubchem Sid

504757197

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504757197

정식 스마일

C1=CC2=C(C(=C1)Br)N=CC=C2

IUPAC Name

8-bromoquinoline

InChIKey

PIWNKSHCLTZKSZ-UHFFFAOYSA-N

INCHI

1S/C9H6BrN/c10-8-5-1-3-7-4-2-6-11-9(7)8/h1-6H

이성체 SMILES

C1=CC2=C(C(=C1)Br)N=CC=C2

WGK 독일

3

대체 CAS

1081803-09-9

분자량

208.05

Reaxy-Rn

115147

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=115147&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • 분류 Quinolines and derivatives
      • Subclass Haloquinolines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• 분류: Quinolines and derivatives
• Subclass: Haloquinolines
• Intermediate Tree Nodes: Not available
• Direct Parent: Haloquinolines
• Alternative Parents: Pyridines and derivatives Benzenoids Aryl bromides Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organobromides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Haloquinoline - Benzenoid - Pyridine - Aryl halide - Aryl bromide - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Organobromide - Organohalogen compound - Aromatic heteropolycyclic compound
• 설명: This compound belongs to the class of organic compounds known as haloquinolines. These are compounds containing a quinoline moiety, which is substituted at one or more ring positions by n halogen atom.
• 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

화학 및 물리적 특성

• 감도: Light sensitive.
• 굴절률: 1.672
• 발화점(°F): 235.4 °F
• 발화점(°C): 113 °C
• 끓는점(°C): 112-113°C
• 분자량: 208.050 g/mol
• XLogP3: 2.500
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 206.968 Da
• Monoisotopic Mass: 206.968 Da
• Topological Polar Surface Area: 12.900 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 138.000
• 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

자주 묻는 질문

What is the purity of this product?

This product is supplied at ≥97% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C, protected from light. The material is light-sensitive — keep it in its original opaque or amber container.

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 16567-18-3, the molecular formula is C9H6BrN, and the molecular weight is 208.05 g/mol. InChIKey PIWNKSHCLTZKSZ-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.