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170703-36-3

170703-36-3 Structure

170703-36-3 Structure
IdentificationBack Directory
[Name]

BENZOIC-4-13C ACID
[CAS]

170703-36-3
[Synonyms]

BENZOIC-4-13C ACID
Benzoic acid-4-13C
Benzoic-4-13C acid (phenyl-4-13C1)
[Molecular Formula]

C7H6O2
[MDL Number]

MFCD01075597
[MOL File]

170703-36-3.mol
[Molecular Weight]

123.13
Chemical PropertiesBack Directory
[Melting point ]

121-125 °C(lit.)
[Boiling point ]

249 °C(lit.)
[Fp ]

121 °C
[InChI]

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

WPYMKLBDIGXBTP-OUBTZVSYSA-N
[SMILES]

OC(=O)c1cc[13cH]cc1
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

22-37/38-41-42/43-36
[Safety Statements ]

22-26-36/37/39-45
[RIDADR ]

UN 3077 9/PG 3
[WGK Germany ]

WGK 1
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Eye Irrit. 2
Hazard InformationBack Directory
[Uses]

- High-resolution NMR spectroscopy
- Metabolomic profiling and pathway analysis
- Stable Isotope probing in Environmental microbiology
- Acid-catalyzed reaction mechanism studies
170703-36-3 suppliers list
Company Name: Merck KGaA  
Telephone: 21-20338288
Website: www.sigmaaldrich.cn
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