tert-Butyl 6-(aminomethyl)-1H-indole-1-carboxylate

Base Information

• Chemical Name: tert-Butyl 6-(aminomethyl)-1H-indole-1-carboxylate
• CAS No.: 887584-21-6
• Molecular Formula: C14H18 N2 O2
• Molecular Weight: 246.3
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID60695390
• Wikidata: Q82624559
• Mol file: 887584-21-6.mol

Synonyms:887584-21-6;tert-Butyl 6-(aminomethyl)-1H-indole-1-carboxylate;tert-butyl 6-(aminomethyl)indole-1-carboxylate;6-AMINOMETHYL-INDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER;DTXSID60695390;AKOS015960008;CS-0362702;FT-0750445;A861484;1h-indole-1-carboxylic acid,6-(aminomethyl)-,1,1-dimethylethyl ester

Chemical Property of tert-Butyl 6-(aminomethyl)-1H-indole-1-carboxylate

Chemical Property:

• Boiling Point: 383.5±34.0 °C(Predicted)
• PKA: 9.02±0.40(Predicted)
• PSA: 57.25000
• Density: 1.14±0.1 g/cm3(Predicted)
• LogP: 3.58350
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 246.136827821
• Heavy Atom Count: 18
• Complexity: 311

Purity/Quality:

97% ^*data from raw suppliers

6-aminomethyl-indole-1-carboxylicacidtert-butylester 95 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)N1C=CC2=C1C=C(C=C2)CN