4-Nitroindane-1,3-dione

Base Information

Chemical Name:4-Nitroindane-1,3-dione
CAS No.:4535-07-3
Molecular Formula:C9H5NO4
Molecular Weight:191.143
Hs Code.:2914700090
European Community (EC) Number:870-399-1
DSSTox Substance ID:DTXSID40371802
Nikkaji Number:J1.509.163K
Wikidata:Q82159253
ChEMBL ID:CHEMBL1532031
Mol file:4535-07-3.mol

Synonyms:4-nitro-1H-indene-1,3(2H)-dione;4535-07-3;4-nitroindane-1,3-dione;4-nitroindene-1,3-dione;1,3-Indandione, 4-nitro-;MLS000861505;SMR000460289;4-nitro-2,3-dihydro-1H-indene-1,3-dione;Maybridge1_006592;1H-Indene-1,3(2H)-dione, 4-nitro-;4-Nitroindan-1,3-dione;4-nitro-1,3-indanedione;4-nitroindane-1,3-quinone;Oprea1_261465;SCHEMBL8062158;CHEMBL1532031;BDBM50742;cid_2737056;HMS560D14;DTXSID40371802;GIJFSQFSAXUVLD-UHFFFAOYSA-N;MFCD00220675;AKOS003267263;FD-0726;FT-0681026;W11433;J-515860

Suppliers and Price of 4-Nitroindane-1,3-dione

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

Matrix Scientific
4-Nitro-1H-indene-1,3(2H)-dione >95%
1g
$ 304.00

Matrix Scientific
4-Nitro-1H-indene-1,3(2H)-dione >95%
500mg
$ 230.00

Crysdot
4-Nitro-1H-indene-1,3(2H)-dione 97%
1g
$ 471.00

Crysdot
4-Nitro-1H-indene-1,3(2H)-dione 97%
5g
$ 1416.00

American Custom Chemicals Corporation
4-NITRO-1H-INDENE-1,3(2H)-DIONE 95.00%
1G
$ 771.89

American Custom Chemicals Corporation
4-NITRO-1H-INDENE-1,3(2H)-DIONE 95.00%
500MG
$ 720.84

AK Scientific
4-Nitro-1H-indene-1,3(2H)-dione
1g
$ 460.00

Total 5 raw suppliers

Chemical Property of 4-Nitroindane-1,3-dione

Chemical Property:

Melting Point:128-130°
PSA：79.96000
LogP:1.88710
XLogP3:1.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:0
Exact Mass:191.02185764
Heavy Atom Count:14
Complexity:306

Purity/Quality:

95% ^*data from raw suppliers

4-Nitro-1H-indene-1,3(2H)-dione >95% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1C(=O)C2=C(C1=O)C(=CC=C2)[N+](=O)[O-]

Technology Process of 4-Nitroindane-1,3-dione

There total 10 articles about 4-Nitroindane-1,3-dione 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: 91.0%

: 39199-63-8
4-nitroindan-1,3-dione-2-carboxylic acid ethyl ester

: 4535-07-3
4-nitro-2,3-dihydro-1H-indene-1,3-dione

Guidance literature:: With trifluoroacetic anhydride; In acetonitrile; at 20 ℃;
DOI:10.1080/00397910802419680

Reference yield: 80.0%

: 1215220-51-1
1,1,3-tribromo-4-nitro-2,3-dihydro-1H-indene

: 4535-07-3
4-nitro-2,3-dihydro-1H-indene-1,3-dione

Guidance literature:: With oxygen; In water; at 120 ℃; for 2h; under 15001.5 Torr; Green chemistry;
DOI:10.1007/s00706-013-0928-4

Reference yield:

: 641-70-3
3-nitrophthalic acid anhydride

: 141-97-9
ethyl acetoacetate

: 4535-07-3
4-nitro-2,3-dihydro-1H-indene-1,3-dione

Guidance literature:: 3-nitrophthalic acid anhydride; ethyl acetoacetate; With triethylamine; In acetic anhydride; at 20 ℃; for 12h; Inert atmosphere;

With hydrogenchloride; In water; acetic anhydride; for 2.5h; Inert atmosphere; Cooling with ice; Reflux;
DOI:10.1016/j.cclet.2018.08.021