NSC 102533 - ≥98% , CAS No.1150-59-0

CAS: 1150-59-0 Cat. No.: N412285 Fórmula: C₁₆H₁₀O₃ Peso molecular: 250.25 PubChem CID: 265893

GRADE & PURITY ≥98%

Synonyms

Antimalarial agent 14 | N17074 | 4-hydroxy-3-phenylnaphthalene-1,2-dione | 1,4-Naphthalenedione, 2-hydroxy-3-phenyl- | 2-Hydroxy-3-phenyl-1,4-naphthoquinone | 4-Hydroxy-3-phenyl-naphthalene-1,2-dione;NSC102533 | Oprea1_075833 | Oprea1_291473 | HY-114197 |

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Visão geral

Information

NSC 102533 is a bioactive compound.

Specifications

Sinónimos

Antimalarial agent 14 | N17074 | 4-hydroxy-3-phenylnaphthalene-1,2-dione | 1,4-Naphthalenedione, 2-hydroxy-3-phenyl- | 2-Hydroxy-3-phenyl-1,4-naphthoquinone | 4-Hydroxy-3-phenyl-naphthalene-1,2-dione;NSC102533 | Oprea1_075833 | Oprea1_291473 | HY-114197 |

Especificações e pureza

≥98%

Mecanismos bioquímicos e fisiológicos

NSC 102533 is a bioactive compound.

Condições de armazenamento de armazenamento

Store at -20°C

Enviado em

Ice chest + Ice pads

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Tipo de ação

INHIBITOR

Pureza

≥98%

Nomes e identificadores

• Pubchem Sid: 528766319
• Sorrisos canónicos: C1=CC=C(C=C1)C2=C(C3=CC=CC=C3C(=O)C2=O)O
• IUPAC Name: 4-hydroxy-3-phenylnaphthalene-1,2-dione
• InChIKey: HCKUADBGJIXWTR-UHFFFAOYSA-N
• INCHI: 1S/C16H10O3/c17-14-11-8-4-5-9-12(11)15(18)16(19)13(14)10-6-2-1-3-7-10/h1-9,17H
• SMILES isoméricas: C1=CC=C(C=C1)C2=C(C3=CC=CC=C3C(=O)C2=O)O
• PubChem CID: 265893
• Peso molecular: 250.25

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Naphthalenes
      • Subclass Phenylnaphthalenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Naphthalenes
• Subclass: Phenylnaphthalenes
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylnaphthalenes
• Alternative Parents: Naphthoquinones Naphthols and derivatives Quinones Aryl ketones Benzene and substituted derivatives Vinylogous acids Enols Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Phenylnaphthalene - Naphthoquinone - 1-naphthol - Aryl ketone - Quinone - Monocyclic benzene moiety - Vinylogous acid - Ketone - Cyclic ketone - Enol - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Aromatic homopolycyclic compound
• Descrição: This compound belongs to the class of organic compounds known as phenylnaphthalenes. These are compounds containing a phenylnaphthalene skeleton, which consists of a naphthalene bound to a phenyl group.
• 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

Propriedades químicas e físicas

• Peso molecular: 250.250 g/mol
• XLogP3: 2.500
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 250.063 Da
• Monoisotopic Mass: 250.063 Da
• Topological Polar Surface Area: 54.400 Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 429.000
• 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