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Application Area
Environmental
Environmental

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

Clinical diagnostic
Clinical diagnostic

In addition to treating various diseases, isotopes are used for imaging, diagnosis, and newborn screening.

Organic Chemistry
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
Metabolic Research

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

Methyl 1-(nitromethyl)cyclohexyl-acetate-[d4]

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General Information
Catalog: BLP-006154
CAS: 1246815-71-3
Molecular Formula: C10H13D4NO4
Molecular Weight: 219.27
Chemical Structure
Methyl 1-(nitromethyl)cyclohexyl-acetate-[d4]
Description Methyl 1-(nitromethyl)cyclohexyl-acetate-[d4] is the labelled analogue of Methyl 1-(nitromethyl)cyclohexyl-acetate, which is an intermediate in the preparation of Gabapentin.
Synonyms 1-(Nitromethyl)cyclohexaneacetic Acid-d4 Methyl Ester; methyl 1-(nitromethyl)cyclohexyl-acetate-d4; Methyl 2-[1-(nitromethyl)cyclohexyl]acetate-d4
IUPAC Name methyl 2,2-dideuterio-2-[1-[dideuterio(nitro)methyl]cyclohexyl]acetate
Related CAS 112777-75-0 (unlabelled)
Canonical SMILES COC(=O)CC1(CCCCC1)C[N+](=O)[O-]
InChI InChI=1S/C10H17NO4/c1-15-9(12)7-10(8-11(13)14)5-3-2-4-6-10/h2-8H2,1H3/i7D2,8D2
InChI Key PYFQWDMBAIDELB-OSEHSPPNSA-N
Solubility Soluble in Dichloromethane, Ethyl Acetate
Appearance Clear Liquid
Storage Store at 2-8°C
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