Benzoic acid-¹³C₇ - ≥99 atom% 13C , CAS No.222412-89-7

CAS: 222412-89-7 Cat. No.: B473872 分子式: ¹³C₆H₅¹³CO₂H 分子量: 129.07 EC番号: 694-268-1

GRADE & PURITY ≥96%(SDS-PAGE)

Synonyms

(carboxy-~13~C_7_)Benzoic acid | Benzoic acid-13C7 | Benzoic acid-13C7, 99 atom % 13C | (1,2,3,4,5,6-13C6)cyclohexatrienecarboxylic acid | DTXSID70584342 | J-014604

Storage

Room temperature

Specifications

同義語

(carboxy-~13~C_7_)Benzoic acid | Benzoic acid-13C7 | Benzoic acid-13C7, 99 atom % 13C | (1,2,3,4,5,6-13C6)cyclohexatrienecarboxylic acid | DTXSID70584342 | J-014604

仕様と純度

≥99 atom% 13C

保管条件

Room temperature

純度

≥96%(SDS-PAGE)

名前と識別子

• カノニカル・スマイル: C1=CC=C(C=C1)C(=O)O
• IUPAC Name: (1,2,3,4,5,6-13C6)cyclohexatrienecarboxylic acid
• InChIKey: WPYMKLBDIGXBTP-BNUYUSEDSA-N
• 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
• 異性体SMILES: [13CH]1=[13CH][13CH]=[13C]([13CH]=[13CH]1)[13C](=O)O
• UN番号: 3077
• 分子量: 129.07
• Reaxy-Rn: 8325189
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=8325189&ln=

化学的性質と物理的性質

• 引火点（°F）: 249.8 °F - closed cup
• 引火点（°C）: 121 °C - closed cup
• 沸点（°C）: 249℃ (lit.)
• 融点（°C）: 121-125℃ (lit.)

よくある質問

What is the isotopic enrichment of this product?

This product is isotopically enriched to ≥99 atom% carbon-13. Isotopic enrichment is a separate specification from chemical purity — a labelled compound has both. Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 222412-89-7, the molecular formula is C7H6O2, and the molecular weight is 129.07 g/mol. InChIKey WPYMKLBDIGXBTP-BNUYUSEDSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.