2-(2-Methoxyethoxy)aniline - ≥97% , CAS No.72806-66-7

CAS: 72806-66-7 Cat. No.: M479412 분자식: C₉H₁₃NO₂ 분자량: 167.21 EC 번호: 276-852-4

GRADE & PURITY ≥97%

Synonyms

EINECS 276-852-4 | 2-(2-methoxyethoxy)phenylamine | 2-(2-Methoxy-ethoxy)-phenylamine | FT-0712120 | 2-(2-Methoxyethoxy)aniline, AldrichCPR | DTXSID20993607 | EN300-54521 | [2-(2-methoxyethoxy)phenyl]amine | Z274541842 | AKOS000100284 | GGVZNGYEHJHVMK-UHFF

Storage

Store at 2-8°C,Protected from light,Argon charged

Shipped In

Wet ice

Specifications

동의어

EINECS 276-852-4 | 2-(2-methoxyethoxy)phenylamine | 2-(2-Methoxy-ethoxy)-phenylamine | FT-0712120 | 2-(2-Methoxyethoxy)aniline, AldrichCPR | DTXSID20993607 | EN300-54521 | [2-(2-methoxyethoxy)phenyl]amine | Z274541842 | AKOS000100284 | GGVZNGYEHJHVMK-UHFF

사양 및 순도

≥97%

보관 조건

Store at 2-8°C,Protected from light,Argon charged

배송

Wet ice

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순수함

≥97%

이름과 식별자

정식 스마일

COCCOC1=CC=CC=C1N

IUPAC Name

2-(2-methoxyethoxy)aniline

InChIKey

GGVZNGYEHJHVMK-UHFFFAOYSA-N

INCHI

1S/C9H13NO2/c1-11-6-7-12-9-5-3-2-4-8(9)10/h2-5H,6-7,10H2,1H3

이성체 SMILES

COCCOC1=CC=CC=C1N

분자량

167.21

Reaxy-Rn

2718830

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2718830&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • 분류 Phenol ethers
      • Subclass Aminophenyl ethers

• Kingdom: Organic compounds
• Superclass: Benzenoids
• 분류: Phenol ethers
• Subclass: Aminophenyl ethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Aminophenyl ethers
• Alternative Parents: Phenoxy compounds Aniline and substituted anilines Alkyl aryl ethers Dialkyl ethers Primary amines Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Aminophenyl ether - Phenoxy compound - Aniline or substituted anilines - Alkyl aryl ether - Monocyclic benzene moiety - Ether - Dialkyl ether - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Primary amine - Organooxygen compound - Organonitrogen compound - Amine - Aromatic homomonocyclic compound
• 설명: This compound belongs to the class of organic compounds known as aminophenyl ethers. These are aromatic compounds that contain a phenol ether, which carries an amine group on the benzene ring.
• 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;Air sensitive
• 분자량: 167.200 g/mol
• XLogP3: 1.000
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 167.095 Da
• Monoisotopic Mass: 167.095 Da
• Topological Polar Surface Area: 44.500 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 119.000
• 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