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491586

Sigma-Aldrich

4-Methylvaleric acid-1-13C

99 atom % 13C

Synonym(s):

4-Methylpentanoic acid-1-13C, Isocaproic acid-1-13C

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About This Item

Linear Formula:
(CH3)2CHCH2CH213CO2H
CAS Number:
286013-24-9
Molecular Weight:
117.15
MDL number:
MFCD00084025
UNSPSC Code:
12352202
PubChem Substance ID:
24872665

isotopic purity

99 atom % 13C

Quality Level

200

refractive index

n20/D 1.4146 (lit.)

bp

199-201 °C (lit.)

density

0.931 g/mL at 25 °C

mass shift

M+1

SMILES string

CC(C)CC[13C](O)=O

InChI

1S/C6H12O2/c1-5(2)3-4-6(7)8/h5H,3-4H2,1-2H3,(H,7,8)/i6+1

InChI key

FGKJLKRYENPLQH-PTQBSOBMSA-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

Corrosion
GHS05

Signal Word

Danger

Hazard Statements

H314

Hazard Classifications

Eye Dam. 1 - Skin Corr. 1C

Storage Class Code

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

WGK

WGK 3

Flash Point(F)

206.6 °F - closed cup

Flash Point(C)

97.00 °C - closed cup

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Certificates of Analysis (COA)

Lot/Batch Number
03344HS

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