1-Indanone oxime

Base Information

• Chemical Name: 1-Indanone oxime
• CAS No.: 3349-60-8
• Molecular Formula: C₉H₉NO
• Molecular Weight: 147.177
• Hs Code.: 2928000090
• European Community (EC) Number: 269-486-1
• NSC Number: 186236
• DSSTox Substance ID: DTXSID501286070
• Mol file: 3349-60-8.mol

Synonyms:1-Indanone oxime;68253-35-0;indan-1-one oxime;3349-60-8;(NE)-N-(2,3-dihydroinden-1-ylidene)hydroxylamine;EINECS 269-486-1;(E)-2,3-Dihydro-1H-inden-1-one oxime;2,3-dihydro-1H-inden-1-one oxime;NSC186236;N-(2,3-dihydroinden-1-ylidene)hydroxylamine;N-(2,3-dihydro-1H-inden-1-ylidene)hydroxylamine;1-Indanone oxime, 98%;SCHEMBL1201517;DTXSID501286070;MFCD00082974;AKOS008939682;NSC-186236;(E)-2,3-Dihydro-1H-inden-1-oneoxime;AM806409;(1E)-2,3-Dihydro-1H-inden-1-one oxime;CS-0036537;A821797;2,3-Dihydro-1H-inden-1-one oxime;N-[(1E)-2,3-dihydro-1H-inden-1-ylidene]hydroxylamine

Chemical Property of 1-Indanone oxime

Chemical Property:

• Appearance/Colour: WHITE TO YELLOW POWDER OR CRYSTALS
• Vapor Pressure: 0.000524mmHg at 25°C
• Melting Point: 147-150 °C(lit.)
• Refractive Index: 1.617
• Boiling Point: 299.7 °C at 760 mmHg
• Flash Point: 179.9 °C
• PSA: 32.59000
• Density: 1.204 g/cm³
• LogP: 1.81110
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 147.068413911
• Heavy Atom Count: 11
• Complexity: 176

Purity/Quality:

97% ^*data from raw suppliers

N-(2,3-dihydroinden-1-ylidene)hydroxylamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1CC(=NO)C2=CC=CC=C21
• Isomeric SMILES: C1C/C(=N\O)/C2=CC=CC=C21

Technology Process of 1-Indanone oxime

There total 13 articles about 1-Indanone oxime 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: 100.0%

inden-1-one (83-33-0) → indan-1-one oxime (68253-35-0,100485-57-2,3349-60-8)

Guidance literature:

With hydroxylamine hydrochloride;

DOI:10.1021/jo902259u

Reference yield: 93.0%

→ indan-1-one oxime (68253-35-0,100485-57-2,3349-60-8)

Guidance literature:

Reference yield: 24.0%

1-indene (95-13-6) → indan-1-one oxime (68253-35-0,100485-57-2,3349-60-8)

Guidance literature:

With ethyl nitrite; tetraethylammonium borohydride; In benzene; for 38h; Ambient temperature;

DOI:10.1021/jo00256a001

upstream raw materials:

inden-1-one

1-indene

indan-1-one-O-(phenylmethyl)oxime

2-(2-carboxyethyl)benzoic acid

Downstream raw materials:

inden-1-one

3,4-dihydro-2(1H)-quinolone

3,4-dihydroisoquinolin-1(2H)-one

indan-1-one-O-(phenylmethyl)oxime