2-Phenylindene - ≥97% , CAS No.4505-48-0

CAS: 4505-48-0 Cat. No.: P170421 Formule: C₁₅H₁₂ Poids moléculaire: 192.26 PubChem CID: 353435

GRADE & PURITY ≥97%

Synonyms

2-Phenylindene | 2-phenyl-indene | MFCD00239514 | 2-Phenyl-1H-indene | NSC601810 | 2-phenyl indene | 2-phenyl-inden | BIC9RKL9H0 | NSC-601810 | Indene, 2-phenyl- | Q27274682 | 1H-Indene, 2-phenyl- | A826708 | 2-Phenyl-1H-indene # | UNII-BIC9RKL9H0 | AKOS0

Storage

Room temperature

Shipped In

Normal

Specifications

Synonymes

2-Phenylindene | 2-phenyl-indene | MFCD00239514 | 2-Phenyl-1H-indene | NSC601810 | 2-phenyl indene | 2-phenyl-inden | BIC9RKL9H0 | NSC-601810 | Indene, 2-phenyl- | Q27274682 | 1H-Indene, 2-phenyl- | A826708 | 2-Phenyl-1H-indene # | UNII-BIC9RKL9H0 | AKOS0

Spécifications et pureté

≥97%

Conditions de stockage de stockage

Room temperature

Expédié en

Normal

Pureté

≥97%

Noms et identifiants

• Pubchem Sid: 488189625
• Sourires canoniques: C1C2=CC=CC=C2C=C1C3=CC=CC=C3
• IUPAC Name: 2-phenyl-1H-indene
• InChIKey: BSBXLZYWGGAVHD-UHFFFAOYSA-N
• INCHI: 1S/C15H12/c1-2-6-12(7-3-1)15-10-13-8-4-5-9-14(13)11-15/h1-10H,11H2
• Isomères SMILES: C1C2=CC=CC=C2C=C1C3=CC=CC=C3
• WGK Allemagne: 3
• PubChem CID: 353435
• Poids moléculaire: 192.26

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Indenes and isoindenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Indenes and isoindenes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Indenes and isoindenes
• Alternative Parents: Benzene and substituted derivatives Aromatic hydrocarbons Polycyclic hydrocarbons Cyclic olefins
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Indene - Monocyclic benzene moiety - Aromatic hydrocarbon - Polycyclic hydrocarbon - Cyclic olefin - Unsaturated hydrocarbon - Olefin - Hydrocarbon - Aromatic homopolycyclic compound
• Description: This compound belongs to the class of organic compounds known as indenes and isoindenes. These are compounds containing an indene moiety(which consists of a cyclopentadiene fused to a benzene ring), or a isoindene moiety (which consists of a cyclopentadiene fused to cyclohexadiene ring).
• 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

• Point de fusion (°C): 157-169 °C
• Poids moléculaire: 192.250 g/mol
• XLogP3: 3.900
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 192.094 Da
• Monoisotopic Mass: 192.094 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 245.000
• 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

Foire aux questions

What is the purity of this product?

This product is supplied at ≥97% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

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 4505-48-0, the molecular formula is C15H12, and the molecular weight is 192.26 g/mol. InChIKey BSBXLZYWGGAVHD-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.