Phthalhydrazide - ≥99% , CAS No.1445-69-8

CAS: 1445-69-8 Cat. No.: P101914 Fórmula: C₈H₆N₂O₂ Peso molecular: 162.15 Número EC: 215-893-4

CALIDAD & PUREZA ≥99%

Synonyms

4-hydroxyphthalazin-1(2H)-one|1,4-Dioxo-1,2,3,4-tetrahydrophthalazine|2-[[2-(4-chlorophenyl)-4 -methyl-5-oxazolyl]methoxy]-2-methylpropionic acid|1,2,3,4-tetrahydrophthalazine-1,4-dione|2,3-Dihydrophthalazine-1,4-dione; 2,3-Dihydro-1,4-phthalazinedione|phthalazine-1,4-diol|2,3-Dihydro-1,4-phthalazinedione|Phthalhydrazide|2,3-dihydro-phthalazine-1,4-dione|2,3-Dihydrophthalazine-1,4-dione|1,4-Phthalazinedione, 2,3-dihydro-|MDMA HYDROCHLORIDE [INCB GREEN LIST]|Phthaloylhydrazine|2,4-PHTHALAZINEDIONE|1,4-di-hydroxyphthalazine|2,3-Dihydro-1,4-phthalazinedione #|2,3-dihydrophathalazine-1,4-dione|hydroxyphthalazinone|dihydroxy-phthalazine|Phthalazine-1,4(2H,3H)-dione

Storage

Room temperature

Shipped In

Normal

Descripción general

application：

Phthalhydrazide is a reagent used in the synthesis of various pyrazolophthalazine derivatives is and used in medicine double hydrazine phthalocyanine work intermediates.

Especificaciones

Sinónimos

4-hydroxyphthalazin-1(2H)-one | 1,4-Dioxo-1,2,3,4-tetrahydrophthalazine | 2-[[2-(4-chlorophenyl)-4 -methyl-5-oxazolyl]methoxy]-2-methylpropionic acid | 1,2,3,4-tetrahydrophthalazine-1,4-dione | 2,3-Dihydrophthalazine-1,4-dione; 2,3-Dihydro-1,4-phthalazinedione | phthalazine-1,4-diol | 2,3-Dihydro-1,4-phthalazinedione | Phthalhydrazide | 2 Show more

Especificaciones y pureza

≥99%

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥99%

Nombres e identificadores

Pubchem Sid

488188641

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488188641

Sonrisas canónicas

C1=CC=C2C(=C1)C(=O)NNC2=O

IUPAC Name

2,3-dihydrophthalazine-1,4-dione

InChIKey

KGLPWQKSKUVKMJ-UHFFFAOYSA-N

INCHI

1S/C8H6N2O2/c11-7-5-3-1-2-4-6(5)8(12)10-9-7/h1-4H,(H,9,11)(H,10,12)

Isómeros SMILES

C1=CC=C2C(=C1)C(=O)NNC2=O

WGK Alemania

3

RTECS

TH8890080

Peso molecular

162.15

Reaxy-Rn

135926

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=135926&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Diazanaphthalenes
      • Subclass Benzodiazines
        • Level5 Phthalazines
          • Level6 Phthalazinones

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Diazanaphthalenes
• Subclass: Benzodiazines
• Intermediate Tree Nodes: Phthalazines
• Direct Parent: Phthalazinones
• Alternative Parents: Pyridazinones Benzenoids Heteroaromatic compounds Lactams Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Phthalazinone - Pyridazinone - Benzenoid - Pyridazine - Heteroaromatic compound - Lactam - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as phthalazinones. These are compounds containing a phthalazine bearing a ketone 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

Propiedades químicas y físicas

• Solubilidad: Soluble in acetone and acetic acid.
• Punto de fusión (°C): >300°C
• Peso molecular: 162.150 g/mol
• XLogP3: 0.900
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 162.043 Da
• Monoisotopic Mass: 162.043 Da
• Topological Polar Surface Area: 58.200 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 203.000
• 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

Preguntas frecuentes

What is the purity of this product?

This product is supplied at ≥99% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

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 1445-69-8, the molecular formula is C8H6N2O2, and the molecular weight is 162.15 g/mol. InChIKey KGLPWQKSKUVKMJ-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.