N-(3-Hydroxypropyl)phthalimide - ≥98% , CAS No.883-44-3

CAS: 883-44-3 Cat. No.: N187621 Fórmula: C₁₁H₁₁NO₃ Peso molecular: 205.2 Número CE: 212-931-1

GRADE & PURITY ≥98%

Synonyms

AKOS002130545 | 2-(3-hydroxy-propyl)-isoindole-1,3-dione | 2-(3-hydroxypropyl)isoindole-1,3-dione | 3-(phthalimido)-propanol | SCHEMBL526807 | SR-01000580138-1 | A862235 | Decalso | STK291435 | UNII-X2TMC7E8YH | DTXSID40236942 | 2-(3-Hydroxypropyl)-2H-iso

Storage

Room temperature,Argon charged

Shipped In

Normal

Visão geral

Product Describtion:

N-(3-Hydroxypropyl)phthalimide is ω-Hydroxyalkylphthalimide and is prepared by mixing phthalic anhydride and propanolamine and by heating at 160-180 °C for 4 hours.

Product Application：

N-(3-Hydroxypropyl)phthalimide was used as standard in the synthesis of phthalimide derivatives at high-temperature, high-pressure and H2O/EtOH mixtures as the solvent. It may be used in the synthesis of hydrophilic phosphorylcholine-containing polymer, poly-2-[3-(methacryloylamino)propylammonio] ethyl 3-aminopropyl phosphate.

Specifications

Sinónimos

AKOS002130545 | 2-(3-hydroxy-propyl)-isoindole-1,3-dione | 2-(3-hydroxypropyl)isoindole-1,3-dione | 3-(phthalimido)-propanol | SCHEMBL526807 | SR-01000580138-1 | A862235 | Decalso | STK291435 | UNII-X2TMC7E8YH | DTXSID40236942 | 2-(3-Hydroxypropyl)-2H-iso

Especificações e pureza

≥98%

Condições de armazenamento de armazenamento

Room temperature,Argon charged

Enviado em

Normal

Pureza

≥98%

Nomes e identificadores

Pubchem Sid

504754494

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504754494

Sorrisos canónicos

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCO

IUPAC Name

2-(3-hydroxypropyl)isoindole-1,3-dione

InChIKey

BSMILTTURCQDGJ-UHFFFAOYSA-N

INCHI

1S/C11H11NO3/c13-7-3-6-12-10(14)8-4-1-2-5-9(8)11(12)15/h1-2,4-5,13H,3,6-7H2

SMILES isoméricas

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCO

WGK Alemanha

3

Peso molecular

205.2

Reaxy-Rn

158489

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=158489&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Isoindoles and derivatives
      • Subclass Isoindolines
        • Level5 Isoindolones
          • Level6 Phthalimides

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Isoindoles and derivatives
• Subclass: Isoindolines
• Intermediate Tree Nodes: Isoindolones
• Direct Parent: Phthalimides
• Alternative Parents: Isoindoles N-substituted carboxylic acid imides Benzenoids Azacyclic compounds Alkanolamines Primary alcohols Organopnictogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Phthalimide - Isoindole - Carboxylic acid imide, n-substituted - Benzenoid - Carboxylic acid imide - Alkanolamine - Carboxylic acid derivative - Azacycle - Alcohol - Primary alcohol - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
• Descrição: This compound belongs to the class of organic compounds known as phthalimides. These are aromatic heterocyclic compounds containing a 1,3-dioxoisoindoline moiety. They are imide derivatives of phthalic anhydrides.
• 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

Propriedades químicas e físicas

• Ponto de fusão (°C): 74-76 °C
• Peso molecular: 205.210 g/mol
• XLogP3: 1.200
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 205.074 Da
• Monoisotopic Mass: 205.074 Da
• Topological Polar Surface Area: 57.600 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 253.000
• 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

Perguntas frequentes

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 under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

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

The CAS Number is 883-44-3, the molecular formula is C11H11NO3, and the molecular weight is 205.2 g/mol. InChIKey BSMILTTURCQDGJ-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.