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4-Anilinomethylenepentenedioic Acid (5-Methyl Ester-[d5])

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Application Area

Metabolic Research

Stable isotope labeling allows researchers to study metabolic pathways in vivo in a safe manner.

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Organic Chemistry

Small molecule compounds labeled with stable isotopes can be used as chemical reference for chemical identification, qualitative, quantitative, detection, etc. Various types of NMR solvents can be used to study the structure, reaction mechanism and reaction kinetics of compounds.

Metabolic Research

Stable isotope labeling allows researchers to study metabolic pathways in vivo in a safe manner.

Environmental

Stable isotope-labeled compounds are used as environmental pollutant standards for the detection of air, water, soil, sediment and food.

4-Anilinomethylenepentenedioic Acid (5-Methyl Ester-[d5])

Name: 4-Anilinomethylenepentenedioic Acid (5-Methyl Ester-[d5])
Brand: BOC Sciences
Rating: 5 (1 reviews)

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General Information
Catalog: BLP-007725
CAS: 1185237-80-2
Molecular Formula: C13H8D5NO4
Molecular Weight: 252.28

Chemical Structure

Description	An isotopic analog of 4-Anilinomethylenepentenedioic Acid 5-Methyl Ester.
Synonyms	4-[(Phenylamino)methylene]-2-pentenedioic Acid 5-Methyl Ester-d5
IUPAC Name	(2E,4Z)-4-methoxycarbonyl-5-(2,3,4,5,6-pentadeuterioanilino)penta-2,4-dienoic acid
Related CAS	64972-00-5 (unlabelled)
Canonical SMILES	COC(=O)C(=CNC1=CC=CC=C1)C=CC(=O)O
InChI	InChI=1S/C13H13NO4/c1-18-13(17)10(7-8-12(15)16)9-14-11-5-3-2-4-6-11/h2-9,14H,1H3,(H,15,16)/b8-7+,10-9-/i2D,3D,4D,5D,6D
InChI Key	FJKGPQZCFBLFIG-GBDHNZSISA-N
Solubility	Soluble in Chloroform, Methanol
Appearance	Yellow Solid