Phenanthrene, 1,2,3,4,9,10-hexahydro-

Base Information

• Chemical Name: Phenanthrene, 1,2,3,4,9,10-hexahydro-
• CAS No.: 16896-36-9
• Molecular Formula: C14H16
• Molecular Weight: 184.281
• NSC Number: 174616
• DSSTox Substance ID: DTXSID90168628
• Wikidata: Q83038246
• Mol file: 16896-36-9.mol

Synonyms:Phenanthrene, 1,2,3,4,9,10-hexahydro-;16896-36-9;NSC 174616;1,2,3,4,9,10-hexahydrophenanthrene;NSC174616;DTXSID90168628;AKOS024321544;NSC-174616;1,2,3,4,9,10-hexahydro-phenanthrene

Chemical Property of Phenanthrene, 1,2,3,4,9,10-hexahydro-

Chemical Property:

• Vapor Pressure: 0.00179mmHg at 25°C
• Boiling Point: 302.3°C at 760 mmHg
• Flash Point: 134.3°C
• Density: 1.04g/cm³
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 184.125200510
• Heavy Atom Count: 14
• Complexity: 249

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC2=C(C1)CCC3=CC=CC=C32

Technology Process of Phenanthrene, 1,2,3,4,9,10-hexahydro-

There total 4 articles about Phenanthrene, 1,2,3,4,9,10-hexahydro- 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: 36.4%

phenanthrene (85-01-8) → 1,2,3,4,4a,9,10,10a-octahydrophenanthrene (16306-39-1) + 9,10-dihydrophenanthrene (776-35-2) + 1,2,3,4,9,10-hexahydrophenanthrene (16896-36-9) + 1,2,3,4,5,6,7,8-Octahydrophenanthrene (5325-97-3)

Guidance literature:

With hydrogen; lithium aluminium tetrahydride; titanium tetrachloride; In n-heptane; at 200 ℃; for 10h; under 67505.4 Torr; Product distribution; other conditions: other solvent (diglyme), other times, other catalysts;;

Reference yield: 3.0%

phenanthrene (85-01-8) → 9,10-dihydrophenanthrene (776-35-2) + 1,2,3,4,9,10-hexahydrophenanthrene (16896-36-9)

Guidance literature:

With hydrogen; lithium aluminium tetrahydride; In diethylene glycol dimethyl ether; at 200 ℃; for 48h; under 67505.4 Torr;

Reference yield: 3.0%

phenanthrene (85-01-8) → 9,10-dihydrophenanthrene (776-35-2) + 1,2,3,4,9,10-hexahydrophenanthrene (16896-36-9) + cis-1,2,3,4,4a,9,10,10a-octahydrophenanthrene (16306-39-1) + trans-1,2,3,4,4a,9,10,10a-Octahydrophenanthrene (16306-39-1) + 1,2,3,9,10,10a-hexahydrophenanthrene (62690-96-4) + 1,4,4a,9,10,10a-hexahydrophenanthrene

Guidance literature:

With tetraethylammonium bromide; In ethanol; at 60 ℃; Product distribution; Kinetics; electrolysis, lead cathode, current yield, var. of potential, current density, amount of electricity, conc.;

DOI:10.1002/prac.19963380166

upstream raw materials:

phenanthrene