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630101

Sigma-Aldrich

2-(Propyl-2,3-13C2)pentanoic-4,5-13C2 acid sodium salt

99 atom % 13C

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About This Item

Linear Formula:
(13CH313CH2CH2)2CHCO2Na
CAS Number:
1173021-77-6
Molecular Weight:
170.16
MDL number:
MFCD08702895
UNSPSC Code:
12352001
PubChem Substance ID:
329759757

isotopic purity

99 atom % 13C

bp

220 °C (lit.)

mass shift

M+4

SMILES string

[Na+].[13CH3][13CH2]CC(C[13CH2][13CH3])C([O-])=O

InChI

1S/C8H16O2.Na/c1-3-5-7(6-4-2)8(9)10;/h7H,3-6H2,1-2H3,(H,9,10);/q;+1/p-1/i1+1,2+1,3+1,4+1;

InChI key

AEQFSUDEHCCHBT-UJNKEPEOSA-M

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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.

pictograms

Health hazardExclamation mark
GHS08,GHS07

signalword

Danger

Hazard Classifications

Acute Tox. 4 Oral - Eye Irrit. 2 - Repr. 1B - Skin Irrit. 2 - STOT SE 3

Storage Class

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

wgk_germany

WGK 3

flash_point_f

231.8 °F - closed cup

flash_point_c

111 °C - closed cup

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Certificates of Analysis (COA)

Lot/Batch Number
MBBB4286V
CR0383

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