2,4-Dichloroquinazoline - ≥95% , CAS No.607-68-1

CAS: 607-68-1 Cat. No.: D185530 Formule: C₈H₄Cl₂N₂ Poids moléculaire: 199 Numéro CE: 612-020-2

QUALITÉ & PURETÉ ≥95%

Synonyms

FT-0600462 | AC-712 | 2,4-Dichloroquinazoline; | A8458 | MFCD00091950 | Z991522362 | F2108-0057 | DTXSID30291383 | BCP27372 | AB03291 | NSC75192 | NSC-75192 | STL503762 | AKOS000291524 | AM20040830 | 2,4-dichloroquinazoline | 2,4-dichloro-quinazoline | SC

Storage

Room temperature

Shipped In

Normal

Spécifications

Synonymes

FT-0600462 | AC-712 | 2,4-Dichloroquinazoline; | A8458 | MFCD00091950 | Z991522362 | F2108-0057 | DTXSID30291383 | BCP27372 | AB03291 | NSC75192 | NSC-75192 | STL503762 | AKOS000291524 | AM20040830 | 2,4-dichloroquinazoline | 2,4-dichloro-quinazoline | SC

Spécifications et pureté

≥95%

Conditions de stockage de stockage

Room temperature

Expédié en

Normal

Pureté

≥95%

Noms et identifiants

Pubchem Sid

504758133

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504758133

Sourires canoniques

C1=CC=C2C(=C1)C(=NC(=N2)Cl)Cl

IUPAC Name

2,4-dichloroquinazoline

InChIKey

TUQSVSYUEBNNKQ-UHFFFAOYSA-N

INCHI

1S/C8H4Cl2N2/c9-7-5-3-1-2-4-6(5)11-8(10)12-7/h1-4H

Isomères SMILES

C1=CC=C2C(=C1)C(=NC(=N2)Cl)Cl

Poids moléculaire

199

Reaxy-Rn

132192

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=132192&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Diazanaphthalenes
      • Subclass Benzodiazines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Diazanaphthalenes
• Subclass: Benzodiazines
• Intermediate Tree Nodes: Not available
• Direct Parent: Quinazolines
• Alternative Parents: 2-halopyrimidines Benzenoids Aryl chlorides Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Quinazoline - 2-halopyrimidine - Halopyrimidine - Aryl chloride - Aryl halide - Benzenoid - Pyrimidine - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organopnictogen compound - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as quinazolines. These are compounds containing a quinazoline moiety, which is made up of two fused six-member aromatic rings, a benzene ring and a pyrimidine ring.
• 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

Propriétés chimiques et physiques

• Poids moléculaire: 199.030 g/mol
• XLogP3: 3.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 197.975 Da
• Monoisotopic Mass: 197.975 Da
• Topological Polar Surface Area: 25.800 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 165.000
• 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

Foire aux questions

What is the purity of this product?

This product is supplied at ≥95% 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 607-68-1, the molecular formula is C8H4Cl2N2, and the molecular weight is 199 g/mol. InChIKey TUQSVSYUEBNNKQ-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.