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1-(3-hydroxy-4-(hydroxymethyl)-cyclopentyl)-5-(2-bromovinyl)-2,4-(1H,3H)-pyrimidinedione is a chemical with a specific purpose. Lookchem provides you with multiple data and supplier information of this chemical.

91661-22-2

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91661-22-2 Usage

Chemical structure

The compound has a cyclopentyl ring with a hydroxyl group and a hydroxymethyl group attached to it, and a 2-bromovinyl group attached to the pyrimidinedione ring.

Class of compound

It belongs to the pyrimidine class of organic compounds.

Common use

It is commonly used in the synthesis of pharmaceuticals and agrochemicals.

Bromovinyl moiety

The presence of the bromovinyl moiety in the compound makes it particularly useful for the development of antiviral and anticancer agents.

Potential applications

The compound has potential applications in the fields of medicine and agriculture due to its unique chemical structure and reactivity.

Functional groups

The compound contains hydroxyl, hydroxymethyl, and bromovinyl functional groups.

Reactivity

The compound's reactivity is influenced by its functional groups and its pyrimidine structure.

Molecular weight

The molecular weight of the compound is approximately 331.15 g/mol.

Solubility

The compound's solubility properties may vary depending on the solvent used, but it is generally soluble in polar solvents like water and methanol.

Check Digit Verification of cas no

The CAS Registry Mumber 91661-22-2 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 9,1,6,6 and 1 respectively; the second part has 2 digits, 2 and 2 respectively.
Calculate Digit Verification of CAS Registry Number 91661-22:
(7*9)+(6*1)+(5*6)+(4*6)+(3*1)+(2*2)+(1*2)=132
132 % 10 = 2
So 91661-22-2 is a valid CAS Registry Number.
InChI:InChI=1/C12H15BrN2O4/c13-2-1-7-5-15(12(19)14-11(7)18)9-3-8(6-16)10(17)4-9/h1-2,5,8-10,16-17H,3-4,6H2,(H,14,18,19)/b2-1+/t8-,9-,10+/m0/s1

91661-22-2SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name (+/-)-1-<(1α,3β,4α)-3-hydroxy-4-(hydroxymethyl)cyclopentyl>-5-<(E)-2-bromovinyl>-2,4(1H,3H)-pyrimidinedione

1.2 Other means of identification

Product number -
Other names (+/-)-(E)-(2-bromoethenyl)-1-<(1α,3β,4α)-3-hydroxy-4-(hydroxymethyl)cyclopent-1-yl>-2,4-(1H,3H)-pyrimidinedione

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:91661-22-2 SDS

91661-22-2Relevant academic research and scientific papers

Synthesis of the Carbocyclic Analogue of the Antiviral Nucleoside (E)-5-(2-Bromovinyl)-2'-deoxyuridine

Cookson, Richard C.,Dudfield, Philip J.,Scopes, David I.C.

, p. 399 - 404 (2007/10/02)

The cyclopentanecarboxylic acid (1) was converted via the isocyanate (2) and the urea (5) into carbocyclic uridine (12).Similarly, the α- and β-epimers of carbocyclic 2'-deoxyuridine, (19a) and (19b), were synthesized from the acids (13).Compounds (19a) and (19b) were furhter modified to afford carbocyclic (E)-5-(2-bromovinyl)-2'-deoxyuridine (25b) and its α-epimer (25a), respectively.

Synthesis and Antiviral Activity of the Carbocyclic Analogues of (E)-5-(2-Halovinyl)-2'-deoxyuridines and (E)-5-(2-Halovinyl)-2'-deoxycytidines

Herdewijn, Piet,Clercq, Erik De,Balzarini, Jan,Vanderhaeghe, Hubert

, p. 550 - 555 (2007/10/02)

The carbocyclic analogues of the potent and selective antiherpes agents (E)-5-(2-bromovinyl)-2'-deoxyuridine (BVDU), (E)-5-(2-iodovinyl)-2'-deoxyuridine (IVDU), and (E)-5-(2-bromovinyl)-2'-deoxycytidine (BVDC) were synthesized by conventional methods with use of carbocyclic 2'-deoxyuridine as starting material.C-BVDU, C-IVDU, and C-BVDC were equally selective, albeit slightly less potent, in their antiherpes action than BVDU, IVDU, and BVDC.Although resistant to degradation by pyrimidine nucleoside phosphorylases, C-BVDU did not prove more effective than BVDU in the systemic (oral, intraperitoneal) or topical treatment of HSV-1 infections in mice.

(±)-carbocyclic (E)-5-(2-bromovinyl)-2'-deoxyuridine: A potent antiherpes agent

Cookson,Dudfield,Newton,et al.

, p. 375 - 377 (2007/10/02)

The synthesis and antiherpes activity of (±)-carbocyclic (E)-5-(2 bromovinyl)-2'-deoxyuridine 1b is described. Compound 1b shows potent activity against HSV-1 in vitro, whereas its α-epimer 2 is only weakly active. The phosphorylation rates of 1b and 2 by HSV thymidine kinases are reported.

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