2-(3-chlorobenzylidene)-3,4-dihydronaphthalen-1(2H)-one

Base Information

Chemical Name:2-(3-chlorobenzylidene)-3,4-dihydronaphthalen-1(2H)-one
CAS No.:61661-18-5
Molecular Formula:C₁₇H₁₃ClO
Molecular Weight:268.743
Hs Code.:
European Community (EC) Number:653-277-0
NSC Number:636724
Nikkaji Number:J1.081.395F
ChEMBL ID:CHEMBL29351

Synonyms:2-(3-chlorobenzylidene)-3,4-dihydronaphthalen-1(2H)-one;NSC636724;MLS003389163;61661-18-5;CHEMBL29351;(2E)-2-[(3-chlorophenyl)methylidene]-1,2,3,4-tetrahydronaphthalen-1-one;AKOS001035352;2-(3-Chlorobenzylidene)tetralin-1-one;NSC-636724;EN300-18169017;EN300-21686391;Z46049272;(2E)-2-(3-chlorobenzylidene)-3,4-dihydronaphthalen-1(2H)-one;2-[(3-chlorophenyl)methylidene]-1,2,3,4-tetrahydronaphthalen-1-one;61926-42-9

Suppliers and Price of 2-(3-chlorobenzylidene)-3,4-dihydronaphthalen-1(2H)-one

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 3 raw suppliers

Chemical Property of 2-(3-chlorobenzylidene)-3,4-dihydronaphthalen-1(2H)-one

Chemical Property:

Melting Point:71 - 74 °C
PSA：17.07000
LogP:4.55250
XLogP3:4.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:268.0654927
Heavy Atom Count:19
Complexity:374

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CC(=CC2=CC(=CC=C2)Cl)C(=O)C3=CC=CC=C31
Isomeric SMILES:C1C/C(=C\C2=CC(=CC=C2)Cl)/C(=O)C3=CC=CC=C31

Technology Process of 2-(3-chlorobenzylidene)-3,4-dihydronaphthalen-1(2H)-one

There total 2 articles about 2-(3-chlorobenzylidene)-3,4-dihydronaphthalen-1(2H)-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: 87.0%

: 587-04-2
m-Chlorobenzaldehyde

: 529-34-0
3,4-dihydronaphthalene-1(2H)-one

: 61926-42-9,61926-49-6,61661-18-5
2-(3′′-chlorobenzylidene)-3,4-dihydro-2H-naphthalen-1-one

Guidance literature:: With silica-gel-supported sulfuric acid; In neat (no solvent); at 65 ℃; for 1.5h; Reagent/catalyst; Temperature; Time; Solvent;
DOI:10.3390/molecules180810081

Reference yield:

: 61926-42-9,61926-49-6,61661-18-5
2-(3′′-chlorobenzylidene)-3,4-dihydro-2H-naphthalen-1-one

Guidance literature:: m-Chlorbenzaldehyd, 1-Tetralon, NaOH-Lsg.;

Reference yield: 91.0%

: 61926-42-9,61926-49-6,61661-18-5
2-(3′′-chlorobenzylidene)-3,4-dihydro-2H-naphthalen-1-one

: 3'-(3-chlorophenyl)-3,4-dihydro-1H-spiro[naphthalene-2,2'-oxiran]-1-one

Guidance literature:: With peracetic acid; iron(II) trifluoroacetate; C₃₀H₃₄N₄O₂; In acetonitrile; at -20 ℃; for 2h; enantioselective reaction;
DOI:10.1021/acs.orglett.5b00018