9-Fluorenone Oxime - ≥97%(GC) , CAS No.2157-52-0

CAS: 2157-52-0 Cat. No.: F132832 Summenformel: C₁₃H₉NO Molekulargewicht: 195.22 Beilstein Registry Number: 7(3)2335

GRADE & PURITY ≥97%(GC)

Synonyms

EN300-15688 | Fluorenone oxime | MFCD00016356 | SY049700 | fluoren-9-one oxime | NSC1988 | NSC-1988 | MLS001181444 | 9-Fluorenone, oxime | HMS1577D07 | SCHEMBL577391 | 4-07-00-01631 (Beilstein Handbook Reference) | DTXSID50175919 | N-(9H-FLUOREN-9-YLIDENE

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyme

EN300-15688 | Fluorenone oxime | MFCD00016356 | SY049700 | fluoren-9-one oxime | NSC1988 | NSC-1988 | MLS001181444 | 9-Fluorenone, oxime | HMS1577D07 | SCHEMBL577391 | 4-07-00-01631 (Beilstein Handbook Reference) | DTXSID50175919 | N-(9H-FLUOREN-9-YLIDENE

Spezifikationen & Reinheit

≥97%(GC)

Storage

Room temperature

Verschickt in

Normal

Reinheit

≥97%(GC)

Namen und Kennungen

Pubchem Sid

488182263

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488182263

Kanonisches Lächeln

C1=CC=C2C(=C1)C3=CC=CC=C3C2=NO

IUPAC Name

N-fluoren-9-ylidenehydroxylamine

InChIKey

CRNNFEKVPRFZKJ-UHFFFAOYSA-N

INCHI

1S/C13H9NO/c15-14-13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)13/h1-8,15H

Isomere SMILES

C1=CC=C2C(=C1)C3=CC=CC=C3C2=NO

RTECS

LL9093000

Molekulargewicht

195.22

Beilstein

7(3)2335

Reaxy-Rn

1871046

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1871046&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: Ketoximes Organopnictogen compounds Organic oxygen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Fluorene - Ketoxime - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen 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

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GLP1R Tclin Glucagon-like peptide 1 receptor (111429 Activities)

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HepG2 (196354 Activities)

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GNAS Tbio Guanine nucleotide-binding protein G(s), subunit alpha (103405 Activities)

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SMAD3 Tchem Mothers against decapentaplegic homolog 3 (68039 Activities)

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MEN1 Tchem Menin/Histone-lysine N-methyltransferase MLL (48157 Activities)

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CGA Tbio Glycoprotein hormones alpha chain (29278 Activities)

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Plasmodium falciparum (966862 Activities)

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Hsf1 Heat shock factor protein 1 (5445 Activities)

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Luciferin 4-monooxygenase (66902 Activities)

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pfk 6-phospho-1-fructokinase (7870 Activities)

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NS1 Nonstructural protein 1 (33327 Activities)

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Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Schmelzpunkt (°C): 193-194°C
• Molekulargewicht: 195.220 g/mol
• XLogP3: 3.800
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 195.068 Da
• Monoisotopic Mass: 195.068 Da
• Topological Polar Surface Area: 32.600 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 250.000
• 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