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487635

Sigma-Aldrich

Isovaleric acid-1-13C

99 atom % 13C

Synonym(s):

3-Methylbutyric acid-1-13C

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About This Item

Linear Formula:
(CH3)2CHCH213CO2H
CAS Number:
87994-84-1
Molecular Weight:
103.12
MDL number:
MFCD00084022
UNSPSC Code:
12352202
PubChem Substance ID:
24872290

isotopic purity

99 atom % 13C

refractive index

n20/D 1.403 (lit.)

bp

175-177 °C (lit.)

mp

−29 °C (lit.)

density

0.946 g/mL at 25 °C

mass shift

M+1

SMILES string

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

InChI

1S/C5H10O2/c1-4(2)3-5(6)7/h4H,3H2,1-2H3,(H,6,7)/i5+1

InChI key

GWYFCOCPABKNJV-HOSYLAQJSA-N

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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

Corrosion
GHS05

Signal Word

Danger

Hazard Statements

H314

Hazard Classifications

Eye Dam. 1 - Skin Corr. 1B

Storage Class Code

8A - Combustible corrosive hazardous materials

WGK

WGK 1

Flash Point(F)

165.2 °F - closed cup

Flash Point(C)

74 °C - closed cup

Certificates of Analysis (COA)

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