6-Methoxy-7h-benzocyclohepten-7-one

Base Information

• Chemical Name: 6-Methoxy-7h-benzocyclohepten-7-one
• CAS No.: 6322-85-6
• Molecular Formula: C12H10 O2
• Molecular Weight: 186.21
• Hs Code.: 2914509090
• NSC Number: 32169
• DSSTox Substance ID: DTXSID60283574
• Nikkaji Number: J1.906.680K
• Mol file: 6322-85-6.mol

Synonyms:6-methoxy-7h-benzocyclohepten-7-one;6322-85-6;NSC32169;DTXSID60283574;8-methoxy-benzo[7]annulen-7-one;NSC 32169;NSC-32169;6-Methoxy-7H-benzo[7]annulen-7-one;6-Methoxy-7H-benzocycloheptene-7-one;AKOS006284796

Chemical Property of 6-Methoxy-7h-benzocyclohepten-7-one

Chemical Property:

• Vapor Pressure: 4.75E-06mmHg at 25°C
• Boiling Point: 382.4°C at 760 mmHg
• Flash Point: 191°C
• PSA: 26.30000
• Density: 1.16g/cm³
• LogP: 2.20860
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 186.068079557
• Heavy Atom Count: 14
• Complexity: 289

Purity/Quality:

6-METHOXY-7H-BENZOCYCLOHEPTEN-7-ONE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC2=CC=CC=C2C=CC1=O

Technology Process of 6-Methoxy-7h-benzocyclohepten-7-one

There total 3 articles about 6-Methoxy-7h-benzocyclohepten-7-one 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: 55.0%

Methoxyacetone (5878-19-3) + o-phthalic dicarboxaldehyde (643-79-8) → 6-Methoxy-7H-benzocyclohepten-7-on (6322-85-6)

Guidance literature:

With potassium carbonate; In methanol; at 40 ℃; for 5h;

DOI:10.1002/hlca.19940770208

Reference yield:

Methoxyacetone (5878-19-3) + water (7732-18-5) + o-phthalic dicarboxaldehyde (643-79-8) → 6-Methoxy-7H-benzocyclohepten-7-on (6322-85-6)

Guidance literature:

Reference yield:

→ 6-Methoxy-7H-benzocyclohepten-7-on (6322-85-6)

Guidance literature:

upstream raw materials:

Methoxyacetone

o-phthalic dicarboxaldehyde

water

Downstream raw materials:

IX-207 887