CAS 179067-99-3

Ethyl 7,7a-dihydro-7-(hydroxyimino)benzo[b]cyclopropa[e]pyran-1a(1H)-carboxylate

Description:

Ethyl 7,7a-dihydro-7-(hydroxyimino)benzo[b]cyclopropa[e]pyran-1a(1H)-carboxylate, identified by its CAS number 179067-99-3, is a chemical compound that features a complex bicyclic structure. This substance is characterized by the presence of a carboxylate ester functional group, which contributes to its reactivity and solubility properties. The hydroxyimino group indicates potential for hydrogen bonding and may influence its biological activity. The bicyclic framework, which includes a cyclopropane moiety, can impart unique steric and electronic properties, making it of interest in medicinal chemistry and organic synthesis. The compound's ethyl ester group enhances its lipophilicity, potentially affecting its pharmacokinetics. Additionally, the presence of multiple functional groups suggests that it may participate in various chemical reactions, including nucleophilic substitutions and condensation reactions. Overall, this compound's structural features may confer specific biological activities, warranting further investigation in the context of drug development or synthetic applications.

Formula: C₁₃H₁₃NO₄

InChI: InChI=1S/C13H13NO4/c1-2-17-12(15)13-7-9(13)11(14-16)8-5-3-4-6-10(8)18-13/h3-6,9,16H,2,7H2,1H3

InChI key: InChIKey=FXCTZFMSAHZQTR-UHFFFAOYSA-N

SMILES: C(OCC)(=O)C12C(C1)C(=NO)C=3C(O2)=CC=CC3

Synonyms:

• 7-(Hydroxyimino)Cyclopropa[B]Chromen-1A-Carboxylate Ethyl Ester
• 7-Hydroxyiminocyclopropan[B]Chromen-1A-Carboxylic Acid Ethyl Ester
• Benzo[b]cyclopropa[e]pyran-1a(1H)-carboxylic acid, 7,7a-dihydro-7-(hydroxyimino)-, ethyl ester
• Ethyl 7,7a-dihydro-7-(hydroxyimino)benzo[b]cyclopropa[e]pyran-1a(1H)-carboxylate
• ethyl (7E)-7-(hydroxyimino)-7,7a-dihydrocyclopropa[b]chromene-1a(1H)-carboxylate
• CHEMBL327783
• CPCCOEt
• CHEMBL 327783

Benzo[b]cyclopropa[e]pyran-1a(1H)-carboxylic acid, 7,7a-dihydro-7-(hydroxyimino)-, ethyl ester

CAS: 179067-99-3

Formula: C₁₃H₁₃NO₄

Purity: 98%

Color and Shape: Solid

Molecular weight: 247.2466

Ref: IN-DA0026R6

CPCCOEt

CAS: 179067-99-3

CPCCOEt

Purity: ≥98%

Molecular weight: 247.25g/mol

Ref: 54-BUP10502

CPCCOEt

CAS: 179067-99-3

CPCCOEt is a low affinity, selective, non-competitive and reversible antagonist of mGluR1b

Formula: C₁₃H₁₃NO₄

Purity: 99.91%

Color and Shape: Solid

Molecular weight: 247.25

Ref: TM-T22692