Precocene ii - ≥98% , CAS No.644-06-4

CAS: 644-06-4 Cat. No.: P340378 Formule: C₁₃H₁₆O₃ Poids moléculaire: 220.26 Beilstein Registry Number: 160683 Numéro CE: 211-408-5 PubChem CID: 12565

GRADE & PURITY ≥98%

Synonyms

CHEBI:35606 | NSC 318792 | Ageratochromene | STL564529 | UNII-1W2R4TRY5H | AI3-36847 | BRN 0160683 | Prococene II | C09018 | NSC318792 | NSC-318792 | 6,7-Dimethoxy-2,2-dimethyl-2H-1-benzopyran | 6,7-Dimethoxy-2,2-dimethyl2H-1-benzopyran | EINECS 211-408-5

Storage

Protected from light,Store at -20°C

Shipped In

Ice chest + Ice pads

Vue d’ensemble

Anti-juvenile hormones that are found in plants. This ends up inducing reversible sterilization and precocious metamorphosis in insects by suppressing the function of the corpora allata gland.

Specifications

Synonymes

CHEBI:35606 | NSC 318792 | Ageratochromene | STL564529 | UNII-1W2R4TRY5H | AI3-36847 | BRN 0160683 | Prococene II | C09018 | NSC318792 | NSC-318792 | 6,7-Dimethoxy-2,2-dimethyl-2H-1-benzopyran | 6,7-Dimethoxy-2,2-dimethyl2H-1-benzopyran | EINECS 211-408-5

Spécifications et pureté

≥98%

Conditions de stockage de stockage

Protected from light,Store at -20°C

Expédié en

Ice chest + Ice pads

Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.

Pureté

≥98%

Noms et identifiants

• Pubchem Sid: 528766796
• Sourires canoniques: CC1(C=CC2=CC(=C(C=C2O1)OC)OC)C
• IUPAC Name: 6,7-dimethoxy-2,2-dimethylchromene
• InChIKey: PTIDGSWTMLSGAH-UHFFFAOYSA-N
• INCHI: 1S/C13H16O3/c1-13(2)6-5-9-7-11(14-3)12(15-4)8-10(9)16-13/h5-8H,1-4H3
• Isomères SMILES: CC1(C=CC2=CC(=C(C=C2O1)OC)OC)C
• WGK Allemagne: 3
• RTECS: DJ2527000
• PubChem CID: 12565
• Poids moléculaire: 220.26
• Beilstein: 160683

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Benzopyrans
      • Subclass 1-benzopyrans

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Benzopyrans
• Subclass: 1-benzopyrans
• Intermediate Tree Nodes: Not available
• Direct Parent: 2,2-dimethyl-1-benzopyrans
• Alternative Parents: Anisoles Alkyl aryl ethers Oxacyclic compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: 2,2-dimethyl-1-benzopyran - Anisole - Alkyl aryl ether - Benzenoid - Oxacycle - Ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as 2,2-dimethyl-1-benzopyrans. These are organic compounds containing a 1-benzopyran moiety that carries two methyl groups at the 2-position.
• External Descriptors: chromenes

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

Discover Target: APEX1

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Mécanismes d'action

Propriétés chimiques et physiques

• Solubilité: Soluble in chloroform, ethyl acetate, and water (partly miscible).
• Sensibilité: Light sensitive
• Indice de réfraction: n20D1.51 (Predicted)
• Point d'ébullition (°C): 300° C at 760 mmHg (Predicted)
• Point de fusion (°C): 42-440° C (lit.)
• Poids moléculaire: 220.260 g/mol
• XLogP3: 3.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 220.11 Da
• Monoisotopic Mass: 220.11 Da
• Topological Polar Surface Area: 27.700 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 272.000
• 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