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1,4-Bismethylenebenzene bisphosphonate ethyl ester is a complex organic compound with the chemical formula C12H18O6P2. It is a type of bisphosphonate, which is a class of drugs used to treat conditions like osteoporosis and Paget's disease by inhibiting bone resorption. This specific compound features a benzene ring with two methylene groups (CH2) attached at the 1 and 4 positions, and two phosphonate groups esterified with ethyl groups. The molecule is characterized by its ability to bind strongly to bone mineral, making it a potential candidate for targeted drug delivery and imaging applications in the field of bone diseases.

4546-05-8

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4546-05-8 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 4546-05-8 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 4,5,4 and 6 respectively; the second part has 2 digits, 0 and 5 respectively.
Calculate Digit Verification of CAS Registry Number 4546-05:
(6*4)+(5*5)+(4*4)+(3*6)+(2*0)+(1*5)=88
88 % 10 = 8
So 4546-05-8 is a valid CAS Registry Number.

4546-05-8Downstream Products

4546-05-8Relevant academic research and scientific papers

Molecular structures of the products of a diphosphonate ester building block with lewis bases

Li, Yufeng,Jian, Fangfang

, p. 14435 - 14450 (2015)

By treating a suitable Wittig reagent under acid conditions, the phosphonate ester 1,4-bimethylenebenzene phosphonate ethyl ester (H2[BBPE], 1) was obtained. As a building block, compound 1 has been reacted with the Lewis-base N,N-dimethylpiperazine, ammonia and NaOH yielded compounds 2-4. The crystal structures show that a 1D chain forming a tubular channel is constructed through hydrogen bonds in 1; hydrogen bonds form two 1D chains with left-hand and right-hand helixes and form 3D networks in compound 2; 1D hydrogen-bond chains are further connected together to afford a 3D network architecture in compound 3; the phosphonate is coordinated by two Na atoms which present different coordination environments in compound 4. Additionally, the relationships between the structure and fluorescence of the four compounds in the solid state and in different solvents have also been studied at room temperature.

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