Methyl indole-3-acetate

  • Formula: C11H11NO2

  • Molecular weight: 189.21

  • Smiles: COC(=O)CC1=CNC2=CC=CC=C21

Download

Methyl indole-3-acetate

Names
Structural Information
Physico-chemical Properties
ADME
Toxicity
Medical Chemistry
Fungi

Names

  • Mycotoxin name: Methyl indole-3-acetate

  • First synonym: 1912-33-0

  • Synonyms: 1912-33-0,methyl 2-(1H-indol-3-yl)acetate,Methyl indole-3-acetate,Methyl 3-indolylacetate,Indole-3-methyl acetate,IAA methyl ester,Methyl 1H-indol-3-ylacetate,Methyl indol-3-ylacetate,Indole-3-acetic acid methyl ester,Indole-3-acetic acid, methyl ester,1H-INDOLE-3-ACETIC ACID, METHYL ESTER,methyl (indol-3-yl)acetate,methyl IAA,UNII-30TIF5OY0K,MeIAA,Methyl 3-indolyacetate,Methyl .beta.-indoleacetate,30TIF5OY0K,Methyl 1H-indole-3-acetate,MFCD00022749,.beta.-Indolylacetic acid methyl ester,EINECS 217-622-5,INDOLE-3-ACETIC ACID METHYLESTER,Methyl beta-indoleacetate,Methyl beta-indolylacetate,Methyl beta -indoleacetate,Methyl beta -indolylacetate,NCIOpen2_000050,Methyl .beta.-indolylacetate,SCHEMBL584367,5-Fluoro-2-mercaptobenzoicacid,CHEMBL4529044,methyl (1H-indol-3-yl)acetate,Methyl 1H-indol-3-ylacetate #,3-Indoleacetic acid methyl ester,CHEBI:72782,AMY2869,DTXSID40172639,ZINC391099,Methylester of 3-Indoleacetic acid,EBD20200,NSC63806,beta-Indolylacetic acid methyl ester,Methyl ester of 3-indoleacetic acid,1H-Indole-3-aceticacid,methyl ester,beta -indolylacetic acid methyl ester,NSC 63806,NSC-63806,s6280,AKOS006229746,CS-W015940,FS-3596,HY-W015224,MCULE-4496787216,SB15032,VI30392,1H-indol-3-yl-acetic acid methyl ester,INDOLE-2-ACETIC ACID METHYL ESTER,SY014240,(1H-indol-3-yl)-acetic acid methyl ester,AB0023108,A4220,FT-0671862,M2605,Methyl indole-3-acetate, >=99.0% (GC),W4102,EN300-28648,C20635,I-1140,Q27140143,Z18279395,Methyl indole-3-acetate, analytical standard, suitable for (for IAA Immunoassay Kit, PGR-3)

Identifiers / External links

Structure

  • Smiles: COC(=O)CC1=CNC2=CC=CC=C21

  • Isomeric smiles: COC(=O)CC1=CNC2=CC=CC=C21

  • Inchi: InChI=1S/C11H11NO2/c1-14-11(13)6-8-7-12-10-5-3-2-4-9(8)10/h2-5,7,12H,6H2,1H3

  • Inchikey: KTHADMDGDNYQRX-UHFFFAOYSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C11H11NO2

  • Molecular weight: 189.21

  • Monoisotopic mass: 189.078978594

Select an endpoint:

Endpoint Tool QSAR ID Value Unit Comments Reference

Select an endpoint:

Category Endpoint Tool QSAR ID Value Unit Comments Reference

Select an endpoint:

Category Sub category Endpoint Tool QSAR ID Value Unit Comments Reference

Select an endpoint:

Endpoint Tool Value Unit Comments Reference

Fungi