Isomescaline

Isomescaline (2,3,4-trimethoxyphenethylamine) is a lesser-known compound based on a well-known psychedelic drug. It is an isomer of mescaline, as well as an analog of TIM-2, TIM-3, and TIM-4. Isomescaline was first synthesized by Alexander Shulgin. In his book PIHKAL, it is suggested that any potentially active dose would be "greater than 400 mg".[1] Despite its structural similarity to mescaline, isomescaline has produced no effects in humans. Very little data exists about the pharmacological properties, metabolism, and toxicity of isomescaline.

Isomescaline

Names
IUPAC name 2-(2,3,4-Trimethoxyphenyl)-ethylamine
Other names 2,3,4-Trimethoxyphenethylamine 2,3,4-Trimethoxy-1-ethaneamine
Identifiers
CAS Number	3937-16-4 Y[PubChem]
3D model (JSmol)	Interactive image
ChEMBL	ChEMBL280797 Y
ChemSpider	366878 Y
PubChem CID	414332
UNII	Y5A6OUU263
CompTox Dashboard (EPA)	DTXSID60192571
InChI InChI=1S/C11H17NO3/c1-13-9-5-4-8(6-7-12)10(14-2)11(9)15-3/h4-5H,6-7,12H2,1-3H3 Y Key: PVLFQRLVSMMSQK-UHFFFAOYSA-N Y InChI=1/C11H17NO3/c1-13-9-5-4-8(6-7-12)10(14-2)11(9)15-3/h4-5H,6-7,12H2,1-3H3 Key: PVLFQRLVSMMSQK-UHFFFAOYAK
SMILES O(c1ccc(c(OC)c1OC)CCN)C
Properties
Chemical formula	C11H17NO3
Molar mass	211.261 g·mol−1
Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa).
N verify (what is YN ?)
Infobox references