Bianthronyl - ≥97% , CAS No.434-84-4

CAS: 434-84-4 Cat. No.: B151967 Formule: C₂₈H₁₈O₂ Poids moléculaire: 386.45 Numéro CE: 635-142-8

QUALITÉ & PURETÉ ≥97%

Synonyms

UNII-PBH43F9Y7H | NSC 102943 | ZQXZUOJNJXNUEO-UHFFFAOYSA-N | [9,9'-Bianthracene]-10,10'(9H,9'H)-dione | NSC102943 | NSC-102943 | 10,10'-Dianthronyl | FT-0632132 | STK063038 | 10,10'-Dihydrodianthrone | SCHEMBL6903914 | (9,9'-Bianthracene)-10,10'(9H,9'H)-d

Storage

Room temperature

Shipped In

Normal

Spécifications

Synonymes

UNII-PBH43F9Y7H | NSC 102943 | ZQXZUOJNJXNUEO-UHFFFAOYSA-N | [9,9'-Bianthracene]-10,10'(9H,9'H)-dione | NSC102943 | NSC-102943 | 10,10'-Dianthronyl | FT-0632132 | STK063038 | 10,10'-Dihydrodianthrone | SCHEMBL6903914 | (9,9'-Bianthracene)-10,10'(9H,9'H)-d

Spécifications et pureté

≥97%

Conditions de stockage de stockage

Room temperature

Expédié en

Normal

Pureté

≥97%

Noms et identifiants

Pubchem Sid

504756355

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504756355

Sourires canoniques

C1=CC=C2C(=C1)C(C3=CC=CC=C3C2=O)C4C5=CC=CC=C5C(=O)C6=CC=CC=C46

IUPAC Name

10-(10-oxo-9H-anthracen-9-yl)-10H-anthracen-9-one

InChIKey

ZQXZUOJNJXNUEO-UHFFFAOYSA-N

INCHI

1S/C28H18O2/c29-27-21-13-5-1-9-17(21)25(18-10-2-6-14-22(18)27)26-19-11-3-7-15-23(19)28(30)24-16-8-4-12-20(24)26/h1-16,25-26H

Isomères SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C3C2=O)C4C5=CC=CC=C5C(=O)C6=CC=CC=C46

Poids moléculaire

386.45

Reaxy-Rn

1916440

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1916440&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Anthracenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Anthracenes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Anthracenes
• Alternative Parents: Aryl ketones Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Anthracene - Aryl ketone - Ketone - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic homopolycyclic compound
• Description: This compound belongs to the class of organic compounds known as anthracenes. These are organic compounds containing a system of three linearly fused benzene rings.
• 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): 272°C(dec.)(lit.)
• Poids moléculaire: 386.400 g/mol
• XLogP3: 6.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 386.131 Da
• Monoisotopic Mass: 386.131 Da
• Topological Polar Surface Area: 34.100 Ų
• Heavy Atom Count: 30
• Formal Charge: 0
• Complexity: 572.000
• 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 434-84-4, the molecular formula is C28H18O2, and the molecular weight is 386.45 g/mol. InChIKey ZQXZUOJNJXNUEO-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.