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277746

Sigma-Aldrich

Benzoic acid-α-13C

99 atom % 13C

Synonym(s):

13C Labeled benzoic acid, Benzoic acid-(carboxy-13C)

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About This Item

Linear Formula:
C6H513CO2H
CAS Number:
3880-99-7
Molecular Weight:
123.11
MDL number:
MFCD00002399
UNSPSC Code:
12352106
PubChem Substance ID:
24856783
NACRES:
NA.12

isotopic purity

99 atom % 13C

Quality Level

200

form

solid

bp

249 °C (lit.)

mp

121-125 °C (lit.)

mass shift

M+1

SMILES string

O[13C](=O)c1ccccc1

InChI

1S/C7H6O2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9)/i7+1

InChI key

WPYMKLBDIGXBTP-CDYZYAPPSA-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

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)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

ISHL Indicated Name

Substances Subject to be Indicated Names

ISHL Notified Names

Substances Subject to be Notified Names

JAN Code

277746-250MG:
277746-BULK:
277746-VAR:
277746-1G:

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Certificates of Analysis (COA)

Lot/Batch Number
MBBD8433
MBBD0116
TV1002
08818KU
081H3752

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Benzoic acid ACS reagent, ≥99.5%

Sigma-Aldrich

242381

Benzoic acid

Madalina Neacsu et al.
Molecular nutrition & food research, 61(3) (2016-07-01)
Phytophenols present in cereals are metabolised to compounds that could be partly responsible for the reduced risk of chronic diseases and all-cause mortality associated with fibre-rich diets. The bioavailability, form and in vivo concentrations of these metabolites require to be

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