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Merck
CN

634727

2-Ketobutyric acid-4-13C,4,4-d2 sodium salt hydrate

98 atom % D, 99 atom % 13C, 98% (CP)

Synonym(s):

α-Keto-butyric acid-4-13C,4,4-d2 sodium hydrate, α-Ketobutyric acid-4-13C,4,4-d2 sodium salt, 2-Oxobutanoic acid-4-13C,4,4-d2 sodium salt, Sodium α-ketobutyrate-4-13C,4,4-d2

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About This Item

Linear Formula:
13CD2HCH2COCO2Na · xH2O
Molecular Weight:
127.08 (anhydrous basis)
NACRES:
NA.12
PubChem Substance ID:
UNSPSC Code:
12352106
MDL number:
Isotopic purity:
99 atom % 13C, 98 atom % D
Assay:
98% (CP)
Mass shift:
M+3
Form:
solid
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InChI

1S/C4H6O3.Na.H2O/c1-2-3(5)4(6)7;;/h2H2,1H3,(H,6,7);;1H2/q;+1;/p-1/i1+1D2;;

SMILES string

O.[Na+].[2H][13CH]([2H])CC(=O)C([O-])=O

InChI key

PVLJVKQSCAHPPR-HZTJCJGNSA-M

isotopic purity

99 atom % 13C, 98 atom % D

assay

98% (CP)

form

solid

technique(s)

bio NMR: suitable

mp

210 °C (dec.) (lit.)

mass shift

M+3

Quality Level

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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.

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Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Information

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