Cyclopenta[d,e,f]phenanthrene - ≥97% , CAS No.203-64-5

CAS: 203-64-5 Cat. No.: C468921 Summenformel: C₁₅H₁₀ Molekulargewicht: 190.24 EG-Nummer: 205-905-6

QUALITÄT & REINHEIT ≥97%

Synonyms

4H-Cyclopenta[def]phenanthrene | Methylenephenanthrene | 4-H-CYCLOPENTA[D,E,F]PHENANTHRENE | DTXSID1024887 | InChI=1/C15H10/c1-3-10-7-8-11-4-2-6-13-9-12(5-1)14(10)15(11)13/h1-8H,9H | EINECS 205-905-6 | NCGC00091166-02 | MFCD00003804 | NCGC00258610-01 | UN

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Übersicht

Description

Cyclopenta[d,e,f]phenanthrene (4,5-methylenephenanthrene) has been used as an indicator in the synthesis of homopolymers and block copolymers of styrene and dienes with variable 1,2-polydiene content.

Spezifikationen

Synonyme

4H-Cyclopenta[def]phenanthrene | Methylenephenanthrene | 4-H-CYCLOPENTA[D,E,F]PHENANTHRENE | DTXSID1024887 | InChI=1/C15H10/c1-3-10-7-8-11-4-2-6-13-9-12(5-1)14(10)15(11)13/h1-8H,9H | EINECS 205-905-6 | NCGC00091166-02 | MFCD00003804 | NCGC00258610-01 | UN

Spezifikationen & Reinheit

≥97%

Storage

Store at 2-8°C,Argon charged

Verschickt in

Wet ice

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥97%

Namen und Kennungen

Kanonisches Lächeln

C1C2=CC=CC3=C2C4=C(C=CC=C41)C=C3

IUPAC Name

tetracyclo[10.2.1.05,14.08,13]pentadeca-1,3,5(14),6,8(13),9,11-heptaene

InChIKey

RKZDZWJDQTZDLD-UHFFFAOYSA-N

INCHI

1S/C15H10/c1-3-10-7-8-11-4-2-6-13-9-12(5-1)14(10)15(11)13/h1-8H,9H2

Isomere SMILES

C1C2=CC=CC3=C2C4=C(C=CC=C41)C=C3

WGK Deutschland

3

RTECS

GY5280000

Molekulargewicht

190.24

Reaxy-Rn

2043908

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2043908&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 Aromatic hydrocarbons Polycyclic hydrocarbons Unsaturated hydrocarbons
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Phenanthrene - Naphthalene - Aromatic hydrocarbon - Polycyclic hydrocarbon - Unsaturated hydrocarbon - Hydrocarbon - 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

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KCNH2 Tclin HERG (29587 Activities)

Discover Target: KCNH2

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CYP3A4 Tclin Cytochrome P450 3A4 (53859 Activities)

Discover Target: CYP3A4

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Lymphoblastoid cell (5959 Activities)

Explore this target

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APEX1 Tchem DNA-(apurinic or apyrimidinic site) lyase (38016 Activities)

Discover Target: APEX1

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Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Molekulargewicht: 190.240 g/mol
• XLogP3: 4.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 190.078 Da
• Monoisotopic Mass: 190.078 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 231.000
• 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