N-(3-Aminopropyl)pyrrolidine - ≥97% , CAS No.23159-07-1

CAS: 23159-07-1 Cat. No.: A113933 Peso molecular: 128.21 Beilstein Registry Number: 20(5)1,415 Número EC: 245-465-2

GRADE & PURITY ≥97%

Synonyms

3-(pyrrolidin-1-yl)propan-1-amine;1-(3-Aminopropyl)-pyrrolidine | 3-(1-Pyrrolidinyl)propylamine | A850957 | (3-pyrrolidin-1-yl)propylamine | N-(3-Aminopropyl)pyrrolidine | N-(3-aminopropyl)-pyrrolidine | NSC 345670 | aminopropylpyrrolidine | DTXSID1066861

Storage

Argon charged,Room temperature

Shipped In

Normal

Descripción general

Application

1-(3-Aminopropyl)pyrrolidine is used as an important raw material and intermediate used in organic Synthesis, pharmaceuticals, agrochemicals and dyestuff. It can be used to make other chemicals It can react with 7-chloro-6-(2-chloro-ethyl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidine to get 5-methyl-8-(3-pyrrolidin-1-yl-propyl)-7,8-dihydro-6H-1,3,4,8,8b-pentaaza-as-indacene . It can also react with 2,4-diphenyl-cyclobutane-1,3-dicarbonyl dichloride to obtain 2,4-diphenyl-cyclobutane-1,3-dicarboxylic acid bis-[(3-pyrrolidin-1-yl-propyl)-amide] .

Specifications

Sinónimos

3-(pyrrolidin-1-yl)propan-1-amine;1-(3-Aminopropyl)-pyrrolidine | 3-(1-Pyrrolidinyl)propylamine | A850957 | (3-pyrrolidin-1-yl)propylamine | N-(3-Aminopropyl)pyrrolidine | N-(3-aminopropyl)-pyrrolidine | NSC 345670 | aminopropylpyrrolidine | DTXSID1066861

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Argon charged, Room temperature

Enviado en

Normal

Pureza

≥97%

Nombres e identificadores

• Sonrisas canónicas: C1CCN(C1)CCCN
• IUPAC Name: 3-pyrrolidin-1-ylpropan-1-amine
• InChIKey: VPBWZBGZWHDNKL-UHFFFAOYSA-N
• INCHI: 1S/C7H16N2/c8-4-3-7-9-5-1-2-6-9/h1-8H2
• Isómeros SMILES: C1CCN(C1)CCCN
• Peso molecular: 128.21
• Beilstein: 20(5)1,415
• Reaxy-Rn: 1191
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1191&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Pyrrolidines
      • Subclass N-alkylpyrrolidines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Pyrrolidines
• Subclass: N-alkylpyrrolidines
• Intermediate Tree Nodes: Not available
• Direct Parent: N-alkylpyrrolidines
• Alternative Parents: Trialkylamines Azacyclic compounds Organopnictogen compounds Monoalkylamines Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: N-alkylpyrrolidine - Tertiary aliphatic amine - Tertiary amine - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Primary aliphatic amine - Amine - Aliphatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as n-alkylpyrrolidines. These are compounds containing a pyrrolidine moiety that is substituted at the N1-position with an alkyl group. Pyrrolidine is a five-membered saturated aliphatic heterocycle with one nitrogen atom and four carbon atoms.
• 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

Propiedades químicas y físicas

• Solubilidad: Soluble in water, soluble in chloroform
• Sensibilidad: Air sensitive.
• Índice de refracción: 1.47-1.472
• Punto de inflamación (°C): 66 °C
• Punto de ebullición (°C): 191-193°C
• Peso molecular: 128.220 g/mol
• XLogP3: 0.200
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 128.131 Da
• Monoisotopic Mass: 128.131 Da
• Topological Polar Surface Area: 29.300 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 67.300
• 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

Referencias

1. Xinlong Liu, Yimeng Li, Xinhua Liu, Yangyang Huang, Fujun Wang, Jiafeng Li, Yuqi Guo, Xinyuan Zhu, Lijuan Zhu, Chuan Zhang.  (2025)  GalNAc End-Capped Poly(β-amino ester)s with Screened Side Chains for Efficient Gene Delivery.  Small Methods,      [PMID:40025903] [10.1002/smtd.202401286]