1,2-Methanodicyclopropa(cd,gh)pentalene, octahydro-

Base Information

• Chemical Name: 1,2-Methanodicyclopropa(cd,gh)pentalene, octahydro-
• CAS No.: 13084-56-5
• Molecular Formula: C9H10
• Molecular Weight: 118.1757
• DSSTox Substance ID: DTXSID70926940
• Nikkaji Number: J53.029H
• Mol file: 13084-56-5.mol

Synonyms:13084-56-5;1,2-Methanodicyclopropa(cd,gh)pentalene, octahydro-;homocuneane;1,2-Methanodicyclopropa[cd,gh]pentalene,octahydro-;DTXSID70926940;Octahydro-1,2-methanodicyclopropa[cd,gh]pentalene

Chemical Property of 1,2-Methanodicyclopropa(cd,gh)pentalene, octahydro-

Chemical Property:

• Vapor Pressure: 2.93mmHg at 25°C
• Boiling Point: 161.7°Cat760mmHg
• Flash Point: 25.1°C
• PSA: 0.00000
• Density: 1.411g/cm³
• LogP: 1.37410
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 118.078250319
• Heavy Atom Count: 9
• Complexity: 188

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C2C3C4C1C5C2C5C34

Technology Process of 1,2-Methanodicyclopropa(cd,gh)pentalene, octahydro-

There total 18 articles about 1,2-Methanodicyclopropa(cd,gh)pentalene, octahydro- 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: 79.0%

pentacyclo<4.3.0.02,5.03.8.04,7>nonane (452-61-9) → Pentacyclo<4.3.0.02,4.03,8.05,7>nonan (13084-56-5)

Guidance literature:

With silver perchlorate; In benzene;

DOI:10.1039/P19810002731

Reference yield:

Pentacyclo<4.3.0.02,5.03,8.04,7>nonane-4-carboxylic acid (15844-05-0) → Pentacyclo<4.3.0.02,4.03,8.05,7>nonan (13084-56-5)

Guidance literature:

Multi-step reaction with 3 steps

1: Br₂, HgO

2: Li / diethyl ether / Heating

3: (isomerization) / AgClO₄ / benzene / 40 °C

With bromine; lithium; mercury(II) oxide; silver perchlorate; In diethyl ether; benzene;

DOI:10.1021/ja00838a025

Reference yield:

C9H9Br → Pentacyclo<4.3.0.02,4.03,8.05,7>nonan (13084-56-5)

Guidance literature:

Multi-step reaction with 2 steps

1: Li / diethyl ether / Heating

2: (isomerization) / AgClO₄ / benzene / 40 °C

With lithium; silver perchlorate; In diethyl ether; benzene;

DOI:10.1021/ja00838a025

upstream raw materials:

Tetracyclo<4.3.0.0^2,4.0^3,7>nonan-8-on-p-toluolsulfonylhydrazon

pentacyclo<4.3.0.0^2,5.0^3.8.0^4,7>nonane

Pentacyclo<4.3.0.0^2,5.0^3,8.0^4,7>nonane-4-carboxylic acid

Pentacyclo<4.3.0.0^2,5.0^3,8.0^4,7>nonan-9-one

Downstream raw materials:

brendane

twistbrendane

Tetracylo<4.3.0.0^3,9.0^4,7>nonan