Spiro[1,3-benzodioxole-2,1'-cyclopentan]-5-amine

Base Information

• Chemical Name: Spiro[1,3-benzodioxole-2,1'-cyclopentan]-5-amine
• CAS No.: 447429-09-6
• Molecular Formula: C₁₁H₁₃NO₂
• Molecular Weight: 191.23
• DSSTox Substance ID: DTXSID00352359
• Wikidata: Q82129453
• ChEMBL ID: CHEMBL1624555
• Mol file: 447429-09-6.mol

Synonyms:447429-09-6;spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-amine;spiro[1,3-benzodioxole-2,1'-cyclopentan]-5-amine;Spiro(benzo[1,3]dioxole-2,1'-cyclopentan)-5-ylamine;Spiro[benzo[d][1,3]dioxole-2,1'-cyclopentan]-5-amine;Spiro[1,3-benzodioxole-2,1//'-cyclopentane]-5-amine;MLS-0268308.0001;Oprea1_084330;SCHEMBL1749235;CHEMBL1624555;BDBM46040;cid_2927039;DTXSID00352359;STK734285;AKOS001747320;SB37222;CS-0340934;EN300-31967;AG-205/40650024;5-Amino-spiro(1,3-benzodioxole-2,1'-cyclopentane);Spiro[1,3-benzodioxol-2,1'-cyclopentane]-5-amine;spiro[1,3-dioxaindane-2,1'-cyclopentane]-6-amine;Spiro[1,3-benzodioxole-2,1-cyclopentan]-5-amine(9ci);SPIRO[1,3-BENZODIOXOLE-2,1'-CYCLOPENTAN]-6-AMINE;5-spiro[1,3-benzodioxole-2,1''-cyclopentane]amine;hydrochloride;spiro[1,3-benzodioxole-2,1''-cyclopentane]-5-amine;spiro[1,3-benzodioxole-2,1''-cyclopentane]-5-ylamine

Chemical Property of Spiro[1,3-benzodioxole-2,1'-cyclopentan]-5-amine

Chemical Property:

• PSA: 44.48000
• LogP: 2.89150
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 191.094628657
• Heavy Atom Count: 14
• Complexity: 225

Purity/Quality:

97% ^*data from raw suppliers

spiro[1,3-benzodioxole-2,1''-cyclopentane]-6-amine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1CCC2(C1)OC3=C(O2)C=C(C=C3)N

Technology Process of Spiro[1,3-benzodioxole-2,1'-cyclopentan]-5-amine

There total 1 articles about Spiro[1,3-benzodioxole-2,1'-cyclopentan]-5-amine which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

spiro[5-nitro-1,3-benzodioxol-2,1'-cyclopentane] (148899-14-3) → LDN-0073507 (447429-09-6)

Guidance literature:

palladium; In methanol;

Reference yield:

LDN-0073507 (447429-09-6) → C21H19NO4

Guidance literature:

Multi-step reaction with 2 steps

1: dimethylformamide / 12 h / Heating

2: H₂O / dimethylformamide / 1 h / 20 °C / sonification

With water; In N,N-dimethyl-formamide;

DOI:10.1055/s-2007-983704

Reference yield:

LDN-0073507 (447429-09-6) + chloro-trimethyl-silane (75-77-4) + 3-Formylchromone (17422-74-1) → C24H27NO4Si

Guidance literature:

In N,N-dimethyl-formamide; for 12h; Heating;

DOI:10.1055/s-2007-983704

upstream raw materials:

spiro[5-nitro-1,3-benzodioxol-2,1'-cyclopentane]

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