33631-94-6 Usage
General Description
7-Acetamido-3,4-dihydro-2H-1,5-benzodioxepine is a chemical compound that belongs to the benzodioxepine class. It is a derivative of benzodioxepine and contains an acetamido group. 7-Acetamido-3,4-dihydro-2H-1,5-benzodioxepine is a white solid, with a molecular formula C11H13NO3, and a molecular weight of 207.23 g/mol. It is also known as 7-acetamido-3,4-dihydro-2H-1,5-benzodioxepine-3-one, and its chemical structure consists of a benzene ring fused with a dioxepine ring and an acetamide side chain. 7-Acetamido-3,4-dihydro-2H-1,5-benzodioxepine has potential applications in the field of pharmaceuticals and medicinal chemistry.
Check Digit Verification of cas no
The CAS Registry Mumber 33631-94-6 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 3,3,6,3 and 1 respectively; the second part has 2 digits, 9 and 4 respectively.
Calculate Digit Verification of CAS Registry Number 33631-94:
(7*3)+(6*3)+(5*6)+(4*3)+(3*1)+(2*9)+(1*4)=106
106 % 10 = 6
So 33631-94-6 is a valid CAS Registry Number.
InChI:InChI=1/C11H13NO3/c1-8(13)12-9-3-4-10-11(7-9)15-6-2-5-14-10/h3-4,7H,2,5-6H2,1H3,(H,12,13)
33631-94-6Relevant articles and documents
Synthesis and crystal structure of 3, 4-dihydro-7-acetamido-2H-1,5-benzodioxepine
Ouerghui, Abid,Hlel, Faouzi,Meganem, Faouzi
, p. 125 - 130 (2007/10/03)
The synthesis of 3,4-dihydro-7-acetamido-2H-1,5-benzodioxepin III is achieved starting from 3,4-dihydro-7-nitro-benzodioxepin II. The new acetamid prepared is characterized by spectroscopic technics, IR; UV; 1H-NMR; 13C-NMR; mass spectrometry and by XR diffraction. A monocrystal from the product is selected and its crystal structure resolved. The solid crystallizes in orthorhombic system with space group Pcab. The crystal cohesion is assumed by hydrogen bonds and Vander-Waals interactions.
