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Merck
CN

700495

Sigma-Aldrich

Phenylacetyl-1-13C chloride

99 atom % 13C

Synonym(s):

2-Phenylacetyl-1-13C chloride

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About This Item

Linear Formula:
C6H5CH213COCl
CAS Number:
63583-47-1
Molecular Weight:
155.59
MDL number:
MFCD12546013
UNSPSC Code:
12352101
PubChem Substance ID:
329762205

Key Documents

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isotopic purity

99 atom % 13C

form

liquid

bp

94-95 °C/12 mmHg

density

1.176 g/mL at 25 °C

mass shift

M+1

storage temp.

2-8°C

SMILES string

Cl[13C](=O)Cc1ccccc1

InChI

1S/C8H7ClO/c9-8(10)6-7-4-2-1-3-5-7/h1-5H,6H2/i8+1

InChI key

VMZCDNSFRSVYKQ-VJJZLTLGSA-N

Related Categories

General description

Phenylacetyl-1-13C chloride 99 atom % 13C is a high-purity isotope product with a unique chemical profile that belongs to the class of isotopes. Produced by Sigma-Aldrich, we are committed to providing quality isotope products and a reliable supply chain. Available in industrial and pre-pack quantities.

Application

- High-resolution NMR spectroscopy
- Metabolomic profiling and pathway analysis
- Stable Isotope probing in Environmental microbiology
- Chlorination reaction mechanism studies

Features and Benefits

Features
  • High-quality deuterated solvent for NMR applications.
  • Maintains stability under various experimental conditions.
  • Optimized for spectroscopic studies of biomolecules.
  • Ensures minimal interference in analytical methods.


Benefits
  • Improves the quality of NMR data for better analysis.
  • Enhances understanding of molecular interactions.
  • Facilitates the discoveryof novel pharmaceuticals.
  • Supports high-quality outcomes in research projects.

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

CorrosionExclamation mark
GHS05,GHS07

Signal Word

Danger

Hazard Statements

H290,H314,H335

Hazard Classifications

Eye Dam. 1 - Met. Corr. 1 - Skin Corr. 1B - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

8A - Combustible corrosive hazardous materials

WGK

WGK 3

Flash Point(F)

215.6 °F - closed cup

Flash Point(C)

102 °C - closed cup

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Certificates of Analysis (COA)

Lot/Batch Number
CX0644

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