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3-(4-Nitrophenyl)propyl bromide, an organic compound with the chemical formula C9H10BrNO2, is a bromide derivative of 4-nitrobenzyl chloride. It is a yellow crystalline solid with a melting point of 65-67°C. This versatile reagent in organic chemistry is used as an intermediate in the synthesis of various pharmaceuticals and organic compounds. Due to its toxic nature and potential to cause irritation to the skin and eyes, it is important to handle 3-(4-Nitrophenyl)propyl broMide with care.

53712-77-9

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53712-77-9 Usage

Uses

Used in Pharmaceutical Industry:
3-(4-Nitrophenyl)propyl bromide is used as a key intermediate in the synthesis of various pharmaceuticals for its ability to facilitate the creation of diverse organic compounds with potential therapeutic applications.
Used in Organic Chemistry Research:
As a building block in the synthesis of organic molecules, 3-(4-Nitrophenyl)propyl bromide is utilized in the preparation of various functionalized compounds, contributing to the advancement of organic chemistry and the development of new chemical entities with specific properties and applications.
Used in Chemical Synthesis:
3-(4-Nitrophenyl)propyl bromide is employed as a versatile reagent in chemical synthesis, enabling the production of a wide range of organic compounds for various applications across different industries, including but not limited to pharmaceuticals, materials science, and agrochemicals.

Check Digit Verification of cas no

The CAS Registry Mumber 53712-77-9 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 5,3,7,1 and 2 respectively; the second part has 2 digits, 7 and 7 respectively.
Calculate Digit Verification of CAS Registry Number 53712-77:
(7*5)+(6*3)+(5*7)+(4*1)+(3*2)+(2*7)+(1*7)=119
119 % 10 = 9
So 53712-77-9 is a valid CAS Registry Number.

53712-77-9SDS

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-(3-bromopropyl)-4-nitrobenzene

1.2 Other means of identification

Product number -
Other names 3-(4-nitrophenyl)propyl bromide

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:53712-77-9 SDS

53712-77-9Relevant academic research and scientific papers

ANTI-FUNGAL TREATMENT

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Paragraph 00117, (2018/03/25)

Provided are compounds, methods, and pharmaceutical compositions useful for treatment of fungal infections, e.g., aspergillosis, candidiasis, cryptococcosis, histoplasmosis, and the like. For example, the pharmaceutical composition may include a pharmaceutically acceptable carrier or excipient, and a compound represented by Ar— C(=NR1)NR2— A---X— Y— Het2 and pharmaceutically acceptable salts thereof. Ar may be an optionally substituted aryl or nitrogen- containing heteroaryl. R1 and R2 may independently be H, optionally substituted C1-C6 aikyi, or optionally substituted C3-C6 cyeloalkyi. A may be a bond or an optionally substituted linking moiety comprising 1, 2, or 3 rings. Each ring in the optionally substituted linking moiety may independently be one of: aryl, cyeloalkyi, heterocycloalkyl, and heteroaryl. X may be O, S, amide, or a bond. Y may be optionally substituted C1-C10 alkyi or optionally substituted C2-C10 alkenyl. Het2 may be an optionally substituted five-membered nitrogen-containing heteroaromatic ring comprising 1, 2, or 3 ring heteroatoms.

Bimodal ligands with macrocyclic and acyclic binding moieties, complexes and compositions thereof, and methods of using

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Page/Page column 56, (2015/09/23)

Substituted 1,4,7-triazacyclononane-N,N′,N″-triacetic acid and 1,4,7,10-tetraazacyclcododecane-N,N′,N″,N′″-tetraacetic acid compounds with a pendant amino or hydroxyl group, metal complexes thereof, compositions thereof, and methods of making and use in diagnostic imaging and treatment of cellular disorders.

4-alkyloxyimino derivatives of uridine-5′-triphosphate: Distal modification of potent agonists as a strategy for molecular probes of P2Y 2, P2Y4, and P2Y6 receptors

Jayasekara, P. Suresh,Barrett, Matthew O.,Ball, Christopher B.,Brown, Kyle A.,Hammes, Eva,Balasubramanian, Ramachandran,Harden, T. Kendall,Jacobson, Kenneth A.

, p. 3874 - 3883 (2014/05/20)

Extended N4-(3-arylpropyl)oxy derivatives of uridine-5′-triphosphate were synthesized and potently stimulated phospholipase C stimulation in astrocytoma cells expressing G protein-coupled human (h) P2Y receptors (P2YRs) activated by UTP (P2Y2/4R) or UDP (P2Y6R). The potent P2Y4R-selective N4-(3- phenylpropyl)oxy agonist was phenyl ring-substituted or replaced with terminal heterocyclic or naphthyl rings with retention of P2YR potency. This broad tolerance for steric bulk in a distal region was not observed for dinucleoside tetraphosphate agonists with both nucleobases substituted. The potent N 4-(3-(4-methoxyphenyl)-propyl)oxy analogue 19 (EC50: P2Y2R, 47 nM; P2Y4R, 23 nM) was functionalized for chain extension using click tethering of fluorophores as prosthetic groups. The BODIPY 630/650 conjugate 28 (MRS4162) exhibited EC50 values of 70, 66, and 23 nM at the hP2Y2/4/6Rs, respectively, and specifically labeled cells expressing the P2Y6R. Thus, an extended N4-(3- arylpropyl)oxy group accessed a structurally permissive region on three G q-coupled P2YRs, and potency and selectivity were modulated by distal structural changes. This freedom of substitution was utilized to design of a pan-agonist fluorescent probe of a subset of uracil nucleotide-activated hP2YRs.

A highly effective bifunctional ligand for radioimmunotherapy applications

Chong, Hyun-Soon,Song, Hyun A.,Kang, Chi Soo,Le, Thien,Sun, Xiang,Dadwal, Mamta,Lee, Hyunbeom,Lan, Xiaoli,Chen, Yunwei,Dai, Anzhi

supporting information; experimental part, p. 5584 - 5586 (2011/06/21)

A novel bifunctional ligand (3p-C-NETA) for antibody-targeted radioimmunotherapy (RIT) of β-emitting radioisotopes 90Y and 177Lu was efficiently synthesized via an unexpected regiospecific ring opening of an aziridinium ion. 3p-C-NET

SIGMA-1 RECEPTOR LIGANDS AND METHODS OF USE

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Page/Page column 41-42, (2010/07/10)

The invention provides compounds of formula I and compositions thereof. The invention further provides methods of using the compounds and compositions. The compounds of the invention can provide high affinity binding to sigma-1 receptors in a mammal. The compounds can exhibit selectivity for the sigma-1 receptor over the sigma-2 receptor. The compounds and compositions of the invention can also be used to treat conditions that involve the sigma-1 receptor, such as addiction, cardiovascular conditions, and cancer, for example, cancer of the breast, lung, prostate, ovarian, colorectal, or the CNS.

Synthesis and characterization of N,N-dialkyl and N-alkyl-N-aralkyl fenpropimorph-derived compounds as high affinity ligands for sigma receptors

Hajipour, Abdol R.,Fontanilla, Dominique,Chu, Uyen B.,Arbabian, Marty,Ruoho, Arnold E.

experimental part, p. 4397 - 4404 (2010/09/12)

The sigma-1 receptor is a unique non-opioid, non-PCP binding site that has been implicated in many different pathophysiological conditions including psychosis, drug addiction, retinal degeneration and cancer. Based on the structure of fenpropimorph, a hig

Ionic liquids on demand in continuous flow

Wilms, Daniel,Klos, Johannes,Kilbinger, Andreas F. M.,Loewe, Holger,Frey, Holger

scheme or table, p. 961 - 964 (2010/04/22)

We report on the development of an alternative protocol for the facile, solvent-free synthesis of various novel imidazolium-based ionic liquids (ILs) that affords highly pure products without the necessity of subsequent purification steps. The continuous

PHENYLALKYL AND PYRIDYLALKYL PIPERAZINE DERIVATIVES

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Page 66-67, (2010/02/07)

This invention relates to compounds of the formula (1) wherein R1, R3, R4, X1, and X2 are defined as in the specification, pharmaceutical compositions containing them and their use in the treatment of central nervous system and other disorders.

BENZAZEPINE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE

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Page 213, (2010/02/06)

The present invention provides a novel benzazepine derivative represented by formula : wherein, R1 is a 5- or 6-membered aromatic ring, R2 is lower alkyl group, etc., Y is an optionally substituted imino group, ring A and ring B are independently an optionally substituted aromatic ring, W is formula -W1-X2-W2- (W1 and W2 are independently S(O)m1 (m1 is 0, 1 or 2), etc., and X2 is an optionally substituted alkylene groupetc. ), a preparation method and use thereof.

Photochemical synthesis of aldehydes in the solid phase

Blankespoor, Ronald L.,DeVries, Tim,Hansen, Eric,Kallemeyn, Jeffrey M.,Klooster, Aaron M.,Mulder, Jason A.,Smart, Robert P.,Vander Griend, Douglas A.

, p. 2677 - 2681 (2007/10/03)

A substituted anthraquinone (AQ), previously shown to photochemically generate benzaldehyde in methanol solution, was attached to a commercially available resin via an 11 carbon tether and an amide bond. Photolysis of the polymer-bound AQ with visible or 350 nm UV light resulted in the formation of benzaldehyde in yields of 50-55% as determined by HPLC. The phenolic positions in the polymer were then alkylated using benzyl bromide and 1-iodo-3-(4-nitrophenyl)propane in a coupling reaction with K2CO3 as a base and a solution-phase proton shuttle. Photolysis of these alkylated polymers resulted in the formation of benzaldehyde (54-89%) and 3-(4-nitrophenyl)-propanal (58-67%). The yields of both aldehydes dropped considerably with subsequent realkylation and photolysis, and the polymer beads began to show signs of deterioration. This is the first time that aldehydes have been made photochemically on a solid-supported phase.

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