N-(2-Hydroxyethyl)succinimide - ≥95% , CAS No.18190-44-8

CAS: 18190-44-8 Cat. No.: I168063 Molecular Weight: 143.14 EC Number: 628-755-7

GRADE & PURITY ≥95%

Synonyms

4,4'-diamino-3,3'-diethyldiphenylmethane | 1-(2-hydroxyethyl) | N-(2-Hydroxyethyl)succinimide | N-(2-HYDROXYETHYL)-SUCCINIMIDE | N-[2-Hydroxyethyl]succinimide | AS-19318 | BBL011763 | FT-0629152 | BICYCLO(3.1.1)HEPTAN-3-OL, 6,6-DIMETHYL-2-METHYLENE-, (1R-

Storage

Room temperature,Argon charged

Shipped In

Normal

Specifications

Synonyms

4, 4'-diamino-3, 3'-diethyldiphenylmethane | 1-(2-hydroxyethyl) | N-(2-Hydroxyethyl)succinimide | N-(2-HYDROXYETHYL)-SUCCINIMIDE | N-[2-Hydroxyethyl]succinimide | AS-19318 | BBL011763 | FT-0629152 | BICYCLO(3.1.1)HEPTAN-3-OL, 6, 6-DIMETHYL-2-METHYLENE-, (1R-

Specifications & Purity

≥95%

Storage

Room temperature, Argon charged

Shipped In

Normal

Purity

≥95%

Names and Identifiers

• Pubchem Sid: 488188886
• Canonical Smiles: C1CC(=O)N(C1=O)CCO
• IUPAC Name: 1-(2-hydroxyethyl)pyrrolidine-2,5-dione
• InChIKey: TWYIPMITVXPNEM-UHFFFAOYSA-N
• INCHI: 1S/C6H9NO3/c8-4-3-7-5(9)1-2-6(7)10/h8H,1-4H2
• Isomeric SMILES: C1CC(=O)N(C1=O)CCO
• WGK Germany: 3
• Molecular Weight: 143.14
• Reaxy-Rn: 124744
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=124744&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Class Carboxylic acids and derivatives
      • Subclass Carboxylic acid derivatives
        • Level5 Carboxylic acid imides
          • Level6 N-substituted carboxylic acid imides

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Class: Carboxylic acids and derivatives
• Subclass: Carboxylic acid derivatives
• Intermediate Tree Nodes: Carboxylic acid imides
• Direct Parent: N-substituted carboxylic acid imides
• Alternative Parents: Pyrrolidine-2-ones N-alkylpyrrolidines Dicarboximides Lactams Azacyclic compounds Alkanolamines Primary alcohols Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Carboxylic acid imide, n-substituted - Pyrrolidone - 2-pyrrolidone - N-alkylpyrrolidine - Dicarboximide - Pyrrolidine - Lactam - Azacycle - Alkanolamine - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Primary alcohol - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Alcohol - Organic nitrogen compound - Carbonyl group - Aliphatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as n-substituted carboxylic acid imides. These are compounds comprising an N-substituted carboxylic acid imide group, with the general structure R1N(C(R2)=O)C(R3)=O (R2,R3=H, alkyl, aryl; R1=Anything but H).
• 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

Chemical and Physical Properties

• Flash Point(°F): 235.4 °F
• Flash Point(°C): 113 °C
• Boil Point(°C): 160-164 °C
• Melt Point(°C): 57-61 °C
• Molecular Weight: 143.140 g/mol
• XLogP3: -1.500
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 143.058 Da
• Monoisotopic Mass: 143.058 Da
• Topological Polar Surface Area: 57.600 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 150.000
• 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