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H49901 Sigma-Aldrich

3-Hydroxyphenylacetic acid

≥99%

  • CAS Number 621-37-4

  • Linear Formula HOC6H4CH2CO2H

  • Molecular Weight 152.15

  •  Beilstein/REAXYS Number 2086506

  •  EC Number 210-684-4

  •  MDL number MFCD00004337

  •  PubChem Substance ID 24895663

  •  NACRES NA.22

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Properties

Related Categories Building Blocks, C8, Carbonyl Compounds, Carboxylic Acids, Chemical Synthesis,
assay   ≥99%
mp   129-133 °C (lit.)
SMILES string   OC(=O)Cc1cccc(O)c1
InChI   1S/C8H8O3/c9-7-3-1-2-6(4-7)5-8(10)11/h1-4,9H,5H2,(H,10,11)
InChI key   FVMDYYGIDFPZAX-UHFFFAOYSA-N

Description

Packaging

25 g in poly bottle

5 g in glass bottle

Other Notes

Tandem Mass Spectrometry data independently generated by Scripps Center for Metabolomics is available to view or download in PDF. H49901.pdf Tested metabolites are featured on Scripps Center for Metabolomics METLIN Metabolite Database. To learn more, visit sigma.com/metlin.

Safety & Documentation

Safety Information

Symbol 
GHS07  GHS07
Signal word 
Warning
Hazard statements 
Precautionary statements 
Personal Protective Equipment 
RIDADR 
NONH for all modes of transport
WGK Germany 
3

Documents

Certificate of Analysis (COA)

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Certificate of Origin (COO)

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Meet Synthia - Retrosynthesis Sofware
Protocols & Articles

Articles

MSMLS Online Plate Map

Metabolite descriptors included with the software download upon purchase of the product include: Name, Parent CID, molecular formula, molecular weight, CAS, ChEBI, HMDB ID, PubChem Compound and Subst...
Keywords: Mass spectrometry, Metabolites

Peer-Reviewed Papers
15

References

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