5H-Benzocycloheptene-5-carboxylicacid,5-amino-6,7,8,9-tetrahydro-,(5S)-(9CI)

Base Information

• Chemical Name: 5H-Benzocycloheptene-5-carboxylicacid,5-amino-6,7,8,9-tetrahydro-,(5S)-(9CI)
• CAS No.: 365526-91-6
• Molecular Formula: C₁₂H₁₅NO₂
• Molecular Weight: 205.257
• Mol file: 365526-91-6.mol

Synonyms:5H-Benzocycloheptene-5-carboxylicacid,5-amino-6,7,8,9-tetrahydro-,(5S)-(9CI)

Chemical Property of 5H-Benzocycloheptene-5-carboxylicacid,5-amino-6,7,8,9-tetrahydro-,(5S)-(9CI)

Chemical Property:

• PSA: 63.32000
• LogP: 2.35190

Purity/Quality:

99% ^*data from raw suppliers

5-amino-6,7,8,9-tetrahydro-5H-benzo[7]annulene-5-carboxylicacid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 5H-Benzocycloheptene-5-carboxylicacid,5-amino-6,7,8,9-tetrahydro-,(5S)-(9CI)

There total 5 articles about 5H-Benzocycloheptene-5-carboxylicacid,5-amino-6,7,8,9-tetrahydro-,(5S)-(9CI) 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: 86.0%

(S)-5-((S)-1-Phenyl-ethylamino)-6,7,8,9-tetrahydro-5H-benzocycloheptene-5-carboxylic acid amide → (S)-1-aminobenzocycloheptane-1-carboxylic acid (365526-91-6)

Guidance literature:

With hydrogenchloride; hydrogen; palladium on activated charcoal; In methanol; for 24h; under 750.06 Torr;

DOI:10.1016/S0040-4020(01)00505-1

Reference yield:

5-(1-phenyl-ethylamino)-6,7,8,9-tetrahydro-5H-benzocycloheptene-5-carbonitrile → (S)-1-aminobenzocycloheptane-1-carboxylic acid (365526-91-6)

Guidance literature:

Multi-step reaction with 2 steps

1: conc. H₂SO₄ / hexane; CH₂Cl₂ / 84 h / 20 °C

2: 86 percent / aq. HCl; H₂ / Pd/C / methanol / 24 h / 750.06 Torr

With hydrogenchloride; sulfuric acid; hydrogen; palladium on activated charcoal; In methanol; hexane; dichloromethane;

DOI:10.1016/S0040-4020(01)00505-1

Reference yield:

(S)-1-aminobenzocycloheptane-1-carboxylic acid hydrochloride → (S)-1-aminobenzocycloheptane-1-carboxylic acid (365526-91-6)

Guidance literature:

With methyloxirane; In ethanol; for 0.333333h; Heating;

DOI:10.1016/S0040-4020(01)00505-1

upstream raw materials:

N-[(R)-2'-hydroxy-1'-phenylethyl]-(S)-1-aminobenzocycloheptane-1-carboxamide