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Merck
CN

217158

Benzoic acid-2,3,4,5,6-d5

≥99 atom % D, ≥99% (CP)

Synonym(s):

Benzoic-d5 acid-(phenyl-d5), Deuterated benzoic acid

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About This Item

Linear Formula:
C6D5CO2H
CAS Number:
1079-02-3
Molecular Weight:
127.15
NACRES:
NA.12
PubChem Substance ID:
24852996
UNSPSC Code:
12352106
EC Number:
214-089-0
MDL number:
MFCD00002400
Isotopic purity:
≥99 atom % D
Assay:
≥99% (CP)
Mass shift:
M+5
Form:
powder

Key Documents

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InChI key

WPYMKLBDIGXBTP-RALIUCGRSA-N

InChI

1S/C7H6O2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9)/i1D,2D,3D,4D,5D

SMILES string

[2H]c1c([2H])c([2H])c(c([2H])c1[2H])C(O)=O

isotopic purity

≥99 atom % D

assay

≥99% (CP)

form

powder

autoignition temp.

1061 °F

bp

249 °C (lit.)

mp

121-125 °C (lit.)

mass shift

M+5

Quality Level

200

Related Categories

General description

Benzoic acid-2,3,4,5,6-d5 ≥99 atom % D, ≥99% (CP) is a high-purity isotope product with a unique chemical profile that belongs to the class of isotopes. Produced by Sigma-Aldrich, we are committed to providing quality isotope products and a reliable supply chain. Available in industrial and pre-pack quantities.

Application

- NMR spectroscopy solvent for biomolecular structure analysis
- Neutron scattering experiments in materials science
- metabolic labeling studies in biological research
- Pharmaceutical formulation development

Features and Benefits

Features
- High-quality solvent for analytical applications
- Improves accuracy in structural analyses
- Non-toxic and environmentally friendly
- Supports a variety of research applications

Benefits
- Ensures high-quality results in analytical experiments
- Increases reliability of obtained data
- Facilitates understanding of complex interactions
- Supports effective therapy development

Packaging

This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.

pictograms

Health hazardCorrosion
GHS08,GHS05

signalword

Danger

Hazard Classifications

Eye Dam. 1 - Skin Irrit. 2 - STOT RE 1 Inhalation

target_organs

Lungs

Storage Class

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Faceshields, Gloves

Regulatory Information

美国出口管控产品
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Certificates of Analysis (COA)

Lot/Batch Number
MBBD1065
MBBC6991
MBBC4398
MBBC2325
MBBB7446V

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R Beiras et al.
Journal of hazardous materials, 360, 452-460 (2018-08-25)
Toxicity of polyethylene microplastics (PE-MP) of size ranges similar to their natural food to zooplanktonic organisms representative of the main taxa present in marine plankton, including rotifers, copepods, bivalves, echinoderms and fish, was evaluated. Early life stages (ELS) were prioritized
Aanindeeta Banerjee et al.
Nature, 531(7593), 215-219 (2016-03-11)
Using carbon dioxide (CO2) as a feedstock for commodity synthesis is an attractive means of reducing greenhouse gas emissions and a possible stepping-stone towards renewable synthetic fuels. A major impediment to synthesizing compounds from CO2 is the difficulty of forming

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