3,3-Pentamethylene glutarimide - ≥98% , CAS No.1130-32-1

CAS: 1130-32-1 Cat. No.: P165984 Peso molecular: 181.24 Número EC: 214-459-1

GRADE & PURITY ≥98%

Synonyms

MFCD00023872 | AM20070539 | 3,3-Pentamethylene glutarimide | NSC 400093 | UNII-WKI07GM35F | DTXSID90150260 | FS-3150 | 3-azaspiro [5,5]-undecane2,4-dione | AKOS009990850 | 3-Azaspiro(5.5)undecane-2,4-dione | Z448241828 | 3-Azaspiro[5.5]undecane-2,4-dione

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Sinónimos

MFCD00023872 | AM20070539 | 3, 3-Pentamethylene glutarimide | NSC 400093 | UNII-WKI07GM35F | DTXSID90150260 | FS-3150 | 3-azaspiro [5, 5]-undecane2, 4-dione | AKOS009990850 | 3-Azaspiro(5.5)undecane-2, 4-dione | Z448241828 | 3-Azaspiro[5.5]undecane-2, 4-dione

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥98%

Nombres e identificadores

• Sonrisas canónicas: C1CCC2(CC1)CC(=O)NC(=O)C2
• IUPAC Name: 3-azaspiro[5.5]undecane-2,4-dione
• InChIKey: FNIPRNMPSXNBDI-UHFFFAOYSA-N
• INCHI: 1S/C10H15NO2/c12-8-6-10(7-9(13)11-8)4-2-1-3-5-10/h1-7H2,(H,11,12,13)
• Isómeros SMILES: C1CCC2(CC1)CC(=O)NC(=O)C2
• Peso molecular: 181.24

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Azaspirodecane derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Azaspirodecane derivatives
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Azaspirodecane derivatives
• Alternative Parents: Piperidinediones Delta lactams N-unsubstituted carboxylic acid imides Dicarboximides Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic heteropolycyclic compounds
• Substituents: Azaspirodecane - Piperidinedione - Delta-lactam - Piperidinone - Piperidine - Carboxylic acid imide - Dicarboximide - Carboxylic acid imide, n-unsubstituted - Lactam - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Carbonyl group - Aliphatic heteropolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as azaspirodecane derivatives. These are organic compounds containing a spirodecane moiety with at least one nitrogen atom.
• 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

Mecanismos de acción

Propiedades químicas y físicas

• Peso molecular: 181.230 g/mol
• XLogP3: 1.600
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 181.11 Da
• Monoisotopic Mass: 181.11 Da
• Topological Polar Surface Area: 46.200 Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 223.000
• 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