2-Ethoxy-3-ethylpyrazine - ≥98% , CAS No.35243-43-7

CAS: 35243-43-7 Cat. No.: E156376 분자식: C₈H₁₂N₂O 분자량: 152.2 Beilstein Registry Number: 23(5)11,173 EC 번호: 662-723-3

GRADE & PURITY ≥98%

Synonyms

AKOS006281407 | 2-Ethoxy-3-ethylpyrazine, 97% | E0812 | Pyrazine, 3-ethoxy-2-ethyl | 3-ethyl-2-ethoxypyrazine | DTXSID00188736 | TYSHGGVMHVIOMH-UHFFFAOYSA-N | FEMA No. 4633 | FT-0639246 | Pyrazine, 2-ethoxy-3-ethyl | Pyrazine, 2-ethoxy-3-ethyl- | Q2725159

Storage

Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Specifications

동의어

AKOS006281407 | 2-Ethoxy-3-ethylpyrazine, 97% | E0812 | Pyrazine, 3-ethoxy-2-ethyl | 3-ethyl-2-ethoxypyrazine | DTXSID00188736 | TYSHGGVMHVIOMH-UHFFFAOYSA-N | FEMA No. 4633 | FT-0639246 | Pyrazine, 2-ethoxy-3-ethyl | Pyrazine, 2-ethoxy-3-ethyl- | Q2725159

사양 및 순도

≥98%

보관 조건

Store at -20°C,Argon charged

배송

Ice chest + Ice pads

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순수함

≥98%

이름과 식별자

• Pubchem Sid: 528756264
• 정식 스마일: CCC1=NC=CN=C1OCC
• IUPAC Name: 2-ethoxy-3-ethylpyrazine
• InChIKey: TYSHGGVMHVIOMH-UHFFFAOYSA-N
• INCHI: 1S/C8H12N2O/c1-3-7-8(11-4-2)10-6-5-9-7/h5-6H,3-4H2,1-2H3
• 이성체 SMILES: CCC1=NC=CN=C1OCC
• 분자량: 152.2
• Beilstein: 23(5)11,173
• Reaxy-Rn: 776695
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=776695&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • 분류 Organooxygen compounds
      • Subclass Ethers

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• 분류: Organooxygen compounds
• Subclass: Ethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Alkyl aryl ethers
• Alternative Parents: Pyrazines Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Alkyl aryl ether - Pyrazine - Heteroaromatic compound - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteromonocyclic compound
• 설명: This compound belongs to the class of organic compounds known as alkyl aryl ethers. These are organic compounds containing the alkyl aryl ether functional group with the generic formula R-O-R' , where R is an alkyl group and R' is an aryl 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

화학 및 물리적 특성

• 분자량: 152.190 g/mol
• XLogP3: 2.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 152.095 Da
• Monoisotopic Mass: 152.095 Da
• Topological Polar Surface Area: 35.000 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 108.000
• 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