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586331

Sigma-Aldrich

Sodium benzoate-d5

98 atom % D

Synonym(s):

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

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About This Item

Linear Formula:
C6D5CO2Na
CAS Number:
Molecular Weight:
149.13
MDL number:
UNSPSC Code:
12352202
PubChem Substance ID:

isotopic purity

98 atom % D

Quality Level

mp

>300 °C (lit.)

mass shift

M+5

SMILES string

[Na+].[2H]c1c([2H])c([2H])c(c([2H])c1[2H])C([O-])=O

InChI

1S/C7H6O2.Na/c8-7(9)6-4-2-1-3-5-6;/h1-5H,(H,8,9);/q;+1/p-1/i1D,2D,3D,4D,5D;

InChI key

WXMKPNITSTVMEF-GWVWGMRQSA-M

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

Exclamation mark

Signal Word

Warning

Hazard Statements

Hazard Classifications

Eye Irrit. 2

Storage Class Code

13 - Non Combustible Solids

WGK

WGK 1

Flash Point(F)

249.8 °F - closed cup

Flash Point(C)

121 °C - closed cup


Certificates of Analysis (COA)

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Belinda S Lennerz et al.
Molecular genetics and metabolism, 114(1), 73-79 (2014-12-17)
Sodium benzoate is a widely used preservative found in many foods and soft drinks. It is metabolized within mitochondria to produce hippurate, which is then cleared by the kidneys. We previously reported that ingestion of sodium benzoate at the generally

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