2-Chloro-3-methylpyridine - ≥98% , CAS No.18368-76-8

CAS: 18368-76-8 Cat. No.: C124347 분자식: C₆H₆ClN 분자량: 127.57 Beilstein Registry Number: 107895 EC 번호: 242-242-1

등급 & 순도 ≥98%

Synonyms

2-Chloro-3-picoline | SY017766 | BCP22229 | AB05179 | Q-101493 | 2-Butene, 1,3-dichloro- | 2-chloro-methyl-pyridine | C1885 | EN300-56057 | DTXSID00171461 | AM20050902 | 2-Chloro-3-methylpyridine, 97% | EINECS 242-242-1 | FT-0649047 | F8880-7769 | 2-Chlor

Storage

Room temperature

Shipped In

Normal

사양

동의어

2-Chloro-3-picoline | SY017766 | BCP22229 | AB05179 | Q-101493 | 2-Butene, 1,3-dichloro- | 2-chloro-methyl-pyridine | C1885 | EN300-56057 | DTXSID00171461 | AM20050902 | 2-Chloro-3-methylpyridine, 97% | EINECS 242-242-1 | FT-0649047 | F8880-7769 | 2-Chlor

사양 및 순도

≥98%

보관 조건

Room temperature

배송

Normal

순수함

≥98%

이름과 식별자

Pubchem Sid

488186429

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488186429

정식 스마일

CC1=C(N=CC=C1)Cl

IUPAC Name

2-chloro-3-methylpyridine

InChIKey

RKVUCIFREKHYTL-UHFFFAOYSA-N

INCHI

1S/C6H6ClN/c1-5-3-2-4-8-6(5)7/h2-4H,1H3

이성체 SMILES

CC1=C(N=CC=C1)Cl

WGK 독일

3

분자량

127.57

Beilstein

107895

Reaxy-Rn

107895

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=107895&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • 분류 Pyridines and derivatives
      • Subclass Halopyridines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• 분류: Pyridines and derivatives
• Subclass: Halopyridines
• Intermediate Tree Nodes: Not available
• Direct Parent: 2-halopyridines
• Alternative Parents: Methylpyridines Aryl chlorides Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: 2-halopyridine - Methylpyridine - Aryl halide - Aryl chloride - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic heteromonocyclic compound
• 설명: This compound belongs to the class of organic compounds known as 2-halopyridines. These are organic compounds containing a pyridine ring substituted at the 2-position by a 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

작용 메커니즘

화학 및 물리적 특성

• 굴절률: 1.533
• 발화점(°F): 174.2 °F
• 발화점(°C): 79°C(Lit.)
• 끓는점(°C): 193°C
• 분자량: 127.570 g/mol
• XLogP3: 2.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 127.019 Da
• Monoisotopic Mass: 127.019 Da
• Topological Polar Surface Area: 12.900 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 74.900
• 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

How should this product be stored?

Store at room temperature.

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 is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

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

The CAS Number is 18368-76-8, the molecular formula is C6H6ClN, and the molecular weight is 127.57 g/mol. InChIKey RKVUCIFREKHYTL-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.