Propylenimine, (+)- - ≥95% , CAS No.83647-99-8

CAS: 83647-99-8 Cat. No.: P978549 PubChem CID: 12207119

GRADE & PURITY ≥95%

Storage

Room temperature

Specifications

Spécifications et pureté

≥95%

Conditions de stockage de stockage

Room temperature

Pureté

≥95%

Noms et identifiants

Sourires canoniques

CC1CN1

IUPAC Name

(2R)-2-methylaziridine

InChIKey

OZDGMOYKSFPLSE-GSVOUGTGSA-N

INCHI

1S/C3H7N/c1-3-2-4-3/h3-4H,2H2,1H3/t3-/m1/s1

Isomères SMILES

C[C@@H]1CN1

CAS alternatif

83647-99-8

PubChem CID

12207119

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Aziridines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Aziridines
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Aziridines
• Alternative Parents: Dialkylamines Azacyclic compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Azacycle - Secondary amine - Secondary aliphatic amine - Aziridine - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Amine - Aliphatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as aziridines. These are organic compounds containing a saturated three-member heterocycle with one amino group and two methylene groups.
• 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

Propriétés chimiques et physiques

• Poids moléculaire: 57.090 g/mol
• XLogP3: 0.000
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 57.0578 Da
• Monoisotopic Mass: 57.0578 Da
• Topological Polar Surface Area: 21.900 Ų
• Heavy Atom Count: 4
• Formal Charge: 0
• Complexity: 26.500
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 1
• 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