2-IODO-9-FLUORENONE , CAS No.3096-46-6

CAS: 3096-46-6 Cat. No.: I169468 Summenformel: C₁₃H₇IO Molekulargewicht: 306.105 EG-Nummer: 654-272-6

Synonyms

2-iodo-9h-fluoren-9-one|2-iodofluoren-9-one|3096-46-6|2-iodo-9-fluorenone|NSC65932|Maybridge1_001975|SCHEMBL1795673|HMS547B17|DTXSID00289974|VRRWYZJLVCUFPU-UHFFFAOYSA-N|NSC-65932|AKOS024319120|FT-0612656

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyme

2-iodo-9h-fluoren-9-one | 2-iodofluoren-9-one | 3096-46-6 | 2-iodo-9-fluorenone | NSC65932 | Maybridge1_001975 | SCHEMBL1795673 | HMS547B17 | DTXSID00289974 | VRRWYZJLVCUFPU-UHFFFAOYSA-N | NSC-65932 | AKOS024319120 | FT-0612656

Storage

Room temperature

Verschickt in

Normal

Namen und Kennungen

• Kanonisches Lächeln: C1=CC=C2C(=C1)C3=C(C2=O)C=C(C=C3)I
• IUPAC Name: 2-iodofluoren-9-one
• InChIKey: VRRWYZJLVCUFPU-UHFFFAOYSA-N
• INCHI: 1S/C13H7IO/c14-8-5-6-10-9-3-1-2-4-11(9)13(15)12(10)7-8/h1-7H
• Isomere SMILES: C1=CC=C2C(=C1)C3=C(C2=O)C=C(C=C3)I
• Molekulargewicht: 306.105
• Reaxy-Rn: 2445759
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2445759&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Klasse Fluorenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: Fluorenes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Fluorenes
• Alternative Parents: Aryl ketones Aryl iodides Organoiodides Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Fluorene - Aryl ketone - Aryl iodide - Aryl halide - Ketone - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organoiodide - Organohalogen compound - Aromatic homopolycyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as fluorenes. These are compounds containing a fluorene moiety, which consists of two benzene rings connected through either a cyclopentane, cyclopentene, or cyclopenta-1,3-diene.
• 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

Chemische und physikalische Eigenschaften

• Molekulargewicht: 306.100 g/mol
• XLogP3: 4.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 305.954 Da
• Monoisotopic Mass: 305.954 Da
• Topological Polar Surface Area: 17.100 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 276.000
• 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

Häufig gestellte Fragen

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 3096-46-6, the molecular formula is C13H7IO, and the molecular weight is 306.105 g/mol. InChIKey VRRWYZJLVCUFPU-UHFFFAOYSA-N.

What documentation is provided?

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