2-AMINOPHENANTHRENE - ≥98% , CAS No.3366-65-2

CAS: 3366-65-2 Cat. No.: A169676 Summenformel: C₁₄H₁₁N Molekulargewicht: 193.25 EG-Nummer: 636-488-2

GRADE & PURITY ≥98%

Synonyms

2-Aminophenanthrene|phenanthren-2-amine|3366-65-2|2-Phenanthrenamine|2-Phenanthrylamine|58E72ZP80W|NSC-402372|CCRIS 7003|Phenanthren-2-ylamine|NSC 402372|BRN 2803482|UNII-58E72ZP80W|4-12-00-03440 (Beilstein Handbook Reference)|WLN: L B666J EZ|CHEMBL312946

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyme

2-Aminophenanthrene | phenanthren-2-amine | 3366-65-2 | 2-Phenanthrenamine | 2-Phenanthrylamine | 58E72ZP80W | NSC-402372 | CCRIS 7003 | Phenanthren-2-ylamine | NSC 402372 | BRN 2803482 | UNII-58E72ZP80W | 4-12-00-03440 (Beilstein Handbook Reference) | WLN: L B666J EZ | CHEMBL312946

Spezifikationen & Reinheit

≥98%

Storage

Room temperature

Verschickt in

Normal

Reinheit

≥98%

Namen und Kennungen

• Pubchem Sid: 504755115
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504755115
• Kanonisches Lächeln: C1=CC=C2C(=C1)C=CC3=C2C=CC(=C3)N
• IUPAC Name: phenanthren-2-amine
• InChIKey: ZEAWSFHWVLOENK-UHFFFAOYSA-N
• INCHI: 1S/C14H11N/c15-12-7-8-14-11(9-12)6-5-10-3-1-2-4-13(10)14/h1-9H,15H2
• Isomere SMILES: C1=CC=C2C(=C1)C=CC3=C2C=CC(=C3)N
• Molekulargewicht: 193.25
• Reaxy-Rn: 2803482
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2803482&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Klasse Phenanthrenes and derivatives

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: Phenanthrenes and derivatives
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenanthrenes and derivatives
• Alternative Parents: Naphthalenes Primary amines Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Phenanthrene - Naphthalene - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Amine - Aromatic homopolycyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as phenanthrenes and derivatives. These are polycyclic compounds containing a phenanthrene moiety, which is a tricyclic aromatic compound with three non-linearly fused benzene.
• 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

Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Molekulargewicht: 193.240 g/mol
• XLogP3: 3.500
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 193.089 Da
• Monoisotopic Mass: 193.089 Da
• Topological Polar Surface Area: 26.000 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 225.000
• 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