(Q27452900)

2-Methyl-5-phenyl-3-furoic acid (English)

19 October 2016

chemical formula

C₁₂H₁₀O₃

1 reference

2-Methyl-5-phenyl-3-furoic acid (English)

19 October 2016

canonical SMILES

CC1=C(C=C(O1)C2=CC=CC=C2)C(=O)O

1 reference

2-Methyl-5-phenyl-3-furoic acid (English)

Jean-Claude Bradley Open Melting Point Dataset

19 October 2016

melting point

183.0 degree Celsius

1 reference

stated in

Identifiers

InChI

InChI=1S/C12H10O3/c1-8-10(12(13)14)7-11(15-8)9-5-3-2-4-6-9/h2-7H,1H3,(H,13,14)

1 reference

2-Methyl-5-phenyl-3-furoic acid (English)

19 October 2016

1 reference

2-Methyl-5-phenyl-3-furoic acid (English)

19 October 2016

0 references

1 reference

2-Methyl-5-phenyl-3-furoic acid (English)

19 October 2016

2 references

2-Methyl-5-phenyl-3-furoic acid (English)

19 October 2016

ChEBI ID

194898

mapping relation type

exact match

1 reference

International Chemical Identifier

InChI

InChI=1S/C12H10O3/c1-8-10(12(13)14)7-11(15-8)9-5-3-2-4-6-9/h2-7H,1H3,(H,13,14)

SureChEMBL ID

SCHEMBL557753

2 references

based on heuristic

inferred from InChIKey

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

1 reference

2 references

DSSTOX compound identifier

DTXCID80304114

0 references

Guide to Pharmacology Ligand ID

10249

1 reference

stated in

IUPHAR/BPS Guide to PHARMACOLOGY

5 February 2021

0 references

0 references

1 reference

4MTA (English)