Jimscaline

Base Information

• Chemical Name: Jimscaline
• CAS No.: 890309-57-6
• Molecular Formula: C13H19NO3
• UNII: EN7Y5Y6S8F
• ChEMBL ID: CHEMBL379780
• DSSTox Substance ID: DTXSID30470414
• Wikidata: Q15409419
• Wikipedia: Jimscaline
• Mol file: 890309-57-6.mol

Synonyms:Jimscaline;890309-57-6;CHEMBL379780;EN7Y5Y6S8F;(R)-(+)-(4,5,6-trimethoxyindan-1-yl)methanamine;SCHEMBL20970921;DTXSID30470414;1H-Indene-1-methanamine, 2,3-dihydro-4,5,6-trimethoxy-, (1R)-;BDBM50190615;PD178221;Q15409419;(1R)-2,3-Dihydro-4,5,6-trimethoxy-1H-indene-1-methanamine;1-[(1R)-4,5,6-trimethoxy-2,3-dihydro-1H-inden-1-yl]methanamine;1H-Indene-1-methanamine 2,3-dihydro-4,5,6-trimethoxy-, (1R)-

Chemical Property of Jimscaline

Chemical Property:

• XLogP3: 1.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 237.13649347
• Heavy Atom Count: 17
• Complexity: 249

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: COC1=C(C(=C2CCC(C2=C1)CN)OC)OC
• Isomeric SMILES: COC1=C(C(=C2CC[C@H](C2=C1)CN)OC)OC