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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.

Efavirenz-[d5]

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General Information
Catalog: BLP-005278
CAS: 1132642-95-5
Molecular Formula: C14H4D5ClF3NO2
Molecular Weight: 320.71
Chemical Structure
Efavirenz-[d5]
Description Efavirenz-[d5] is the labelled analogue of Efavirenz. Efavirenz is an antiretroviral medication used to treat and prevent HIV/AIDS.
Synonyms Efavirenz D5; Sustiva-d5; Stocrin-d5; DMP-266-d5; EFV-d5; (4S)-6-Chloro-4-(Cyclopropylethynyl)-1,4-Dihydro-4-(Trifluoromethyl)-2H-3,1-Benzoxazin-2-One-d5
IUPAC Name (4S)-6-chloro-4-[2-(1,2,2,3,3-pentadeuteriocyclopropyl)ethynyl]-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one
Related CAS 154598-52-4 (unlabelled)
Isomeric SMILES [2H]C1(C(C1([2H])C#C[C@]2(C3=C(C=CC(=C3)Cl)NC(=O)O2)C(F)(F)F)([2H])[2H])[2H]
Canonical SMILES C1CC1C#CC2(C3=C(C=CC(=C3)Cl)NC(=O)O2)C(F)(F)F
InChI InChI=1S/C14H9ClF3NO2/c15-9-3-4-11-10(7-9)13(14(16,17)18,21-12(20)19-11)6-5-8-1-2-8/h3-4,7-8H,1-2H2,(H,19,20)/t13-/m0/s1/i1D2,2D2,8D
InChI Key XPOQHMRABVBWPR-XWJABCKYSA-N
Boiling Point 340.6±42.0°C at 760 mmHg
Melting Point 182-185°C
Purity >98%
Density 1.5±0.1 g/cm3
Solubility Soluble in Chloroform, DMSO, Methanol
Appearance Off-white to Pale Beige Solid
Storage Store at -20°C
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