2-Ethylaniline - ≥98% , CAS No.578-54-1

CAS: 578-54-1 Cat. No.: E106226 Formule: C₈H₁₁N Poids moléculaire: 121.18 Beilstein Registry Number: 1841268 Numéro CE: 209-424-2

GRADE & PURITY ≥98%

Synonyms

F2190-0421 | PD127635 | 2-ETHYLANILINE [HSDB] | UN2273 | 2-Ethylaniline, 98% | 2-Ethylphenylamine | 2-Ethyl-phenylamine | AI3-26296 | A831636 | BENZENE,1-AMINO,2-ETHYL | 2-Ethylbenzeneamine | NSC-62014 | UNII-GR557N47K6 | 2-Ethylbenzenamine | NSC 62014 |

Storage

Protected from light,Room temperature,Argon charged

Shipped In

FedEx DG Service

Specifications

Synonymes

F2190-0421 | PD127635 | 2-ETHYLANILINE [HSDB] | UN2273 | 2-Ethylaniline, 98% | 2-Ethylphenylamine | 2-Ethyl-phenylamine | AI3-26296 | A831636 | BENZENE,1-AMINO,2-ETHYL | 2-Ethylbenzeneamine | NSC-62014 | UNII-GR557N47K6 | 2-Ethylbenzenamine | NSC 62014 |

Spécifications et pureté

≥98%

Conditions de stockage de stockage

Protected from light,Room temperature,Argon charged

Expédié en

FedEx DG Service

Pureté

≥98%

Noms et identifiants

Pubchem Sid

488181312

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488181312

Sourires canoniques

CCC1=CC=CC=C1N

IUPAC Name

2-ethylaniline

InChIKey

MLPVBIWIRCKMJV-UHFFFAOYSA-N

INCHI

1S/C8H11N/c1-2-7-5-3-4-6-8(7)9/h3-6H,2,9H2,1H3

Isomères SMILES

CCC1=CC=CC=C1N

WGK Allemagne

3

RTECS

BX9800000

Numéro ONU

2273

Groupe d'emballage

III

Poids moléculaire

121.18

Beilstein

1841268

Reaxy-Rn

1841268

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1841268&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Benzene and substituted derivatives
      • Subclass Aniline and substituted anilines

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Aniline and substituted anilines
• Intermediate Tree Nodes: Not available
• Direct Parent: Aniline and substituted anilines
• Alternative Parents: Primary amines Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Aniline or substituted anilines - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Amine - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as aniline and substituted anilines. These are organic compounds containing an aminobenzene moiety.
• 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

Propriétés chimiques et physiques

• Solubilité: Insoluble in water, soluble in ethanol, toluene, etc.
• Sensibilité: Air sensitive ；Light sensitive
• Indice de réfraction: 1.559
• Point d'éclair (°F): 199.4 °F
• Point d'éclair (°C): 93.4 °C
• Point d'ébullition (°C): 210°C
• Point de fusion (°C): -44°C
• Poids moléculaire: 121.180 g/mol
• XLogP3: 1.700
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 121.089 Da
• Monoisotopic Mass: 121.089 Da
• Topological Polar Surface Area: 26.000 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 80.600
• 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

Foire aux questions

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 room temperature, protected from light, under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product is classified as dangerous goods and ships via FedEx DG Service. Ground and other economy services are not available, and delivery to some destinations or address types may be restricted.

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

The CAS Number is 578-54-1, the molecular formula is C8H11N, and the molecular weight is 121.18 g/mol. InChIKey MLPVBIWIRCKMJV-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.