490253

Methyl benzoate-α-¹³C

99 atom % ¹³C

• Linear Formula: C₆H₅¹³CO₂CH₃
• CAS Number: 36712-21-7
• Molecular Weight: 137.14
• MDL number: MFCD00084019
• UNSPSC Code: 12352202
• PubChem Substance ID: 24872546

Properties

• isotopic purity: 99 atom % ¹³C
• assay: 99% (CP)
• refractive index: n20/D 1.517 (lit.)
• bp: 198-199 °C (lit.)
• mp: −12 °C (lit.)
• density: 1.102 g/mL at 25 °C
• mass shift: M+1
• SMILES string: CO[13C](=O)c1ccccc1
• InChI: 1S/C8H8O2/c1-10-8(9)7-5-3-2-4-6-7/h2-6H,1H3/i8+1
• InChI key: QPJVMBTYPHYUOC-VJJZLTLGSA-N

Description

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.

Safety Information

• pictograms: GHS07
• signalword: Warning
• hcodes: H302
• pcodes: P264 - P270 - P301 + P312 - P501
• Hazard Classifications: Acute Tox. 4 Oral
• Storage Class: 10 - Combustible liquids
• wgk_germany: WGK 1
• flash_point_f: 181.4 °F - closed cup
• flash_point_c: 83 °C - closed cup