4-Nitrophthalic anhydride

Base Information Edit

Chemical Name:4-Nitrophthalic anhydride
CAS No.:5466-84-2
Molecular Formula:C8H3NO5
Molecular Weight:193.116
Hs Code.:29173990
European Community (EC) Number:226-776-2
NSC Number:26424
UNII:SQN32UA63N
DSSTox Substance ID:DTXSID6025775
Nikkaji Number:J104.459A
Wikidata:Q27289349
ChEMBL ID:CHEMBL1373184
Mol file:5466-84-2.mol

Synonyms:4-NITROPHTHALIC ANHYDRIDE;5466-84-2;5-nitroisobenzofuran-1,3-dione;5-Nitro-2-benzofuran-1,3-dione;Phthalic anhydride, 4-nitro-;4-Nitrophthalic acid anhydride;1,3-Isobenzofurandione, 5-nitro-;5-Nitrophthalic anhydride;CCRIS 4684;5-Nitro-1,3-isobenzofurandione;EINECS 226-776-2;MFCD00005922;NSC 26424;UNII-SQN32UA63N;BRN 0179682;SQN32UA63N;DTXSID6025775;NSC-26424;5-17-11-00267 (Beilstein Handbook Reference);NSC26424;4nitrophthalic anhydride;4-nitro phthalic anhydride;4-Nitro-phthalic anhydride;MLS002454378;SCHEMBL158311;DTXCID005775;CHEMBL1373184;4-Nitrophthalic anhydride, 92%;HMS3039P05;5-nitroisobenzo[b]furan-1,3-dione;NITROPHTHALIC ANHYDRIDE, 4-;3-Pyridinecarboxylicacidmagnesiumsalt;Tox21_200328;STK677046;5-Nitro-2-benzofuran-1,3-dione #;AKOS003236943;AC-4828;CS-W008336;LS-1347;NCGC00091647-01;NCGC00091647-02;NCGC00257882-01;SMR001371998;SY019126;CAS-5466-84-2;FT-0619294;N0246;EN300-33368;5-nitro-1,3-dihydro-2-benzofuran-1,3-dione;H11894;AE-508/40879362;Q-200505;Q27289349

Suppliers and Price of 4-Nitrophthalic anhydride

Supply Marketing:Edit

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

Usbiological
4-Nitrophthalic anhydride
10g
$ 386.00

TRC
4-Nitrophthalic anhydride
10g
$ 120.00

TRC
4-Nitrophthalic anhydride
100g
$ 375.00

TCI Chemical
4-Nitrophthalic Anhydride >97.0%(T)
100g
$ 385.00

TCI Chemical
4-Nitrophthalic Anhydride >97.0%(T)
25g
$ 131.00

Sigma-Aldrich
4-Nitrophthalic anhydride 92%
5g
$ 39.30

Sigma-Aldrich
4-Nitrophthalic anhydride 92%
25g
$ 163.00

Matrix Scientific
4-Nitrophthalic anhydride
10g
$ 172.00

Frontier Specialty Chemicals
4-Nitrophthalic anhydride
25g
$ 151.00

Frontier Specialty Chemicals
4-Nitrophthalic anhydride
5g
$ 38.00

Total 97 raw suppliers

Chemical Property of 4-Nitrophthalic anhydride Edit

Chemical Property:

Appearance/Colour:off-white to light yellow-brown powder
Melting Point:116-120 °C(lit.)
Refractive Index:1.585
Boiling Point:396.5 °C at 760 mmHg
Flash Point:217.8 °C
PSA：89.19000
Density:1.687 g/cm³
LogP:1.42860
Storage Temp.:Inert atmosphere,Room Temperature
Sensitive.:Moisture Sensitive
Solubility.:Acetone (Slightly), Chloroform (Slightly), Methanol (Slightly)
Water Solubility.:Hydrolysis
XLogP3:1.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:0
Exact Mass:193.00112220
Heavy Atom Count:14
Complexity:307

Purity/Quality:

99% ^*data from raw suppliers

4-Nitrophthalic anhydride ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xn
Hazard Codes:Xi,Xn
Statements: 36/37/38-20/22
Safety Statements: 26-36-36/37/39-22

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:C1=CC2=C(C=C1[N+](=O)[O-])C(=O)OC2=O
Uses 5-Nitrophthalic Anhydride is used in the preparation of phthalic acids as well as compounds with anticonvulsant activities. 4-Nitrophthalic anhydride is used an an intermediate for the synthesis of a benzimidazole PARP inhibitor I (succinate salt) (ABT-472).

Technology Process of 4-Nitrophthalic anhydride

There total 7 articles about 4-Nitrophthalic anhydride 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: 93.0%