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217158

Sigma-Aldrich

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
EC Number:
214-089-0
MDL number:
MFCD00002400
UNSPSC Code:
12352106
PubChem Substance ID:
24852996
NACRES:
NA.12

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

SMILES string

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

InChI

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

InChI key

WPYMKLBDIGXBTP-RALIUCGRSA-N

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

wgk_germany

WGK 1

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

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

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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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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