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586234

Sigma-Aldrich

Benzoic acid-13C7

99 atom % 13C

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About This Item

Linear Formula:
13C6H513CO2H
CAS Number:
222412-89-7
Molecular Weight:
129.07
MDL number:
MFCD00190275
UNSPSC Code:
12352106
PubChem Substance ID:
24881107
NACRES:
NA.12

isotopic purity

99 atom % 13C

bp

249 °C (lit.)

mp

121-125 °C (lit.)

mass shift

M+7

SMILES string

O[13C](=O)[13c]1[13cH][13cH][13cH][13cH][13cH]1

InChI

1S/C7H6O2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9)/i1+1,2+1,3+1,4+1,5+1,6+1,7+1

InChI key

WPYMKLBDIGXBTP-BNUYUSEDSA-N

Related Categories

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 hazardCorrosion
GHS08,GHS05

Signal Word

Danger

Hazard Statements

H315,H318,H372

Hazard Classifications

Eye Dam. 1 - Skin Irrit. 2 - STOT RE 1 Inhalation

Target Organs

Lungs

Storage Class Code

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

WGK

WGK 1

Flash Point(F)

249.8 °F - closed cup

Flash Point(C)

121 °C - closed cup

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Certificates of Analysis (COA)

Lot/Batch Number
MBBC4664
ST1775

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