N-Ethylurea - ≥95% , CAS No.625-52-5

CAS: 625-52-5 Cat. No.: E105944 Summenformel: C₃H₈N₂O Molekulargewicht: 88.11 Beilstein Registry Number: 1740512 EG-Nummer: 210-898-8

QUALITÄT & REINHEIT ≥95%

Synonyms

Pellethane | E0192 | Urea, 1-ethyl- | N-Ethylurea, 97% | Q26840850 | Athylisoharnstoff | InChI=1/C3H8N2O/c1-2-5-3(4)6/h2H2,1H3,(H3,4,5,6 | Ethylurea | DTXSID20873854 | Urea, ethyl- | 7K14B03X18 | NSC 53556 | A833843 | ETHYLUREA, N- | EINECS 210-898-8 | EN

Storage

Room temperature

Shipped In

Normal

Übersicht

Application：

N-Ethyl urea, is a versatile building block, that can be used in organic synthesis of various pharmaceutical and biologically active compounds, as nitrogen and carbonyl source.

Spezifikationen

Synonyme

Pellethane | E0192 | Urea, 1-ethyl- | N-Ethylurea, 97% | Q26840850 | Athylisoharnstoff | InChI=1/C3H8N2O/c1-2-5-3(4)6/h2H2,1H3,(H3,4,5,6 | Ethylurea | DTXSID20873854 | Urea, ethyl- | 7K14B03X18 | NSC 53556 | A833843 | ETHYLUREA, N- | EINECS 210-898-8 | EN

Spezifikationen & Reinheit

≥95%

Storage

Room temperature

Verschickt in

Normal

Reinheit

≥95%

Namen und Kennungen

Pubchem Sid

488181596

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488181596

Kanonisches Lächeln

CCNC(=O)N

IUPAC Name

ethylurea

InChIKey

RYECOJGRJDOGPP-UHFFFAOYSA-N

INCHI

1S/C3H8N2O/c1-2-5-3(4)6/h2H2,1H3,(H3,4,5,6)

Isomere SMILES

CCNC(=O)N

WGK Deutschland

3

RTECS

YT2335000

Molekulargewicht

88.11

Beilstein

1740512

Reaxy-Rn

1740512

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1740512&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Klasse Organic carbonic acids and derivatives
      • Subclass Ureas

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Klasse: Organic carbonic acids and derivatives
• Subclass: Ureas
• Intermediate Tree Nodes: Not available
• Direct Parent: Ureas
• Alternative Parents: Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Urea - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aliphatic acyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as ureas. These are compounds containing two amine groups joined by a carbonyl (C=O) functional 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

Chemische und physikalische Eigenschaften

• Löslichkeit: Soluble in methanol (25 mg/ml), and water (100 mg/ml).
• Empfindlichkeit: Moisture sensitive
• Flammpunkt (°F): 199.4 °F
• Flammpunkt (°C): 93 °C
• Schmelzpunkt (°C): 92°C
• Molekulargewicht: 88.110 g/mol
• XLogP3: -0.700
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 88.0637 Da
• Monoisotopic Mass: 88.0637 Da
• Topological Polar Surface Area: 55.100 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 52.800
• 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