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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

Quality Level

200

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

Related Categories

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

CorrosionHealth hazard
GHS05,GHS08

Signal Word

Danger

Hazard Statements

H315 - H318 - H372

Hazard Classifications

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

Target Organs

Lungs

Storage Class Code

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

WGK

WGK 1

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

ISHL Indicated Name

Substances Subject to be Indicated Names

ISHL Notified Names

Substances Subject to be Notified Names

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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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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