5-Phenylpyrimidin - ≥95% , CAS No.34771-45-4

CAS: 34771-45-4 Cat. No.: P192898 Summenformel: C₁₀H₈N₂ Molekulargewicht: 156.18 PubChem CID: 817373

GRADE & PURITY ≥95%

Synonyms

5-phenylpyrimidine | 5-Phenyl-pyrimidine | AC-26644 | J-517929 | 2-Dodecyl-N-(2,2,6,6-tetrmethyl-4-piperidiny)succinimide | AC-907/25005006 | DS-12676 | AMY11541 | SMR001295101 | FT-0646141 | A874864 | LVXOXXGCJHYEOS-UHFFFAOYSA-N | AKOS003399855 | MLS0022

Storage

Lagerung bei 2-8°C

Shipped In

Nasses Eis

Specifications

Synonyme

5-phenylpyrimidine | 5-Phenyl-pyrimidine | AC-26644 | J-517929 | 2-Dodecyl-N-(2,2,6,6-tetrmethyl-4-piperidiny)succinimide | AC-907/25005006 | DS-12676 | AMY11541 | SMR001295101 | FT-0646141 | A874864 | LVXOXXGCJHYEOS-UHFFFAOYSA-N | AKOS003399855 | MLS0022

Spezifikationen & Reinheit

≥95%

Storage

Lagerung bei 2-8°C

Verschickt in

Nasses Eis

Reinheit

≥95%

Namen und Kennungen

Pubchem Sid

504760192

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504760192

Kanonisches Lächeln

C1=CC=C(C=C1)C2=CN=CN=C2

IUPAC Name

5-phenylpyrimidine

InChIKey

LVXOXXGCJHYEOS-UHFFFAOYSA-N

INCHI

1S/C10H8N2/c1-2-4-9(5-3-1)10-6-11-8-12-7-10/h1-8H

Isomere SMILES

C1=CC=C(C=C1)C2=CN=CN=C2

PubChem CID

817373

Molekulargewicht

156.18

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Klasse Diazines
      • Subclass Pyrimidines and pyrimidine derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: Diazines
• Subclass: Pyrimidines and pyrimidine derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyrimidines and pyrimidine derivatives
• Alternative Parents: Benzene and substituted derivatives Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Benzenoid - Pyrimidine - Monocyclic benzene moiety - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteromonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as pyrimidines and pyrimidine derivatives. These are compounds containing a pyrimidne ring, which is a six-member aromatic heterocycle which consists of two nitrogen atoms (at positions 1 and 3) and four carbon atoms.
• 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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ATM Tchem Serine-protein kinase ATM (4198 Activities)

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HT-29 (80576 Activities)

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MCF7 (126967 Activities)

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HEK293 (82097 Activities)

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POLI Tchem DNA polymerase iota (116820 Activities)

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CBX1 Tbio Chromobox protein homolog 1 (92434 Activities)

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Mycobacterium avium (4587 Activities)

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Mycobacterium tuberculosis (203094 Activities)

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Mus musculus (284745 Activities)

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GCN5 Histone acetyltransferase GCN5 (89 Activities)

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Mycolicibacter terrae (137 Activities)

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Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Molekulargewicht: 156.180 g/mol
• XLogP3: 1.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 156.069 Da
• Monoisotopic Mass: 156.069 Da
• Topological Polar Surface Area: 25.800 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 124.000
• 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