CAS Number31643-49-9
Synonymsp-nitrophthalonitrile; 4-Nitrophthalonitrile; 3,4-Dicyanonitrobenzene; 5-Nitro-1,2-benzenedicarbonitrile; Phthalonitrile,4-nitro; 5-Nitrobenzene-1,2-dicarbonitrile; 1,2-Dicyano-4-nitrobenzene; 4-nitrophthalodinitrile; 4-Nitro-1,2-benzenedicarbonitrile; 4-nitro-1,2-dicyanobenzene; 4-nitro-phthalonitrile; 4-nitrophthalic acid dinitrile; EINECS 250-748-9; 1,2-Benzenedicarbonitrile,4-nitro; MFCD00040301
Molecular FormulaO2NC6H3-1,2-(CN)2
Molecular Weight173.13
Purity99%
Density1.4±0.1 g/cm3
Boiling Point389.9±37.0 °C at 760 mmHg
Melting Point142-144 °C (lit.)
Appearancepowder, crystals or chunks
EINECS250-748-9
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 31643-49-9 |
| Catalog No. | 2A-9006050 |
| Chinese Name | 4-硝基邻苯二甲腈 |
| Synonyms | p-nitrophthalonitrile; 4-Nitrophthalonitrile; 3,4-Dicyanonitrobenzene; 5-Nitro-1,2-benzenedicarbonitrile; Phthalonitrile,4-nitro; 5-Nitrobenzene-1,2-dicarbonitrile; 1,2-Dicyano-4-nitrobenzene; 4-nitrophthalodinitrile; 4-Nitro-1,2-benzenedicarbonitrile; 4-nitro-1,2-dicyanobenzene; 4-nitro-phthalonitrile; 4-nitrophthalic acid dinitrile; EINECS 250-748-9; 1,2-Benzenedicarbonitrile,4-nitro; MFCD00040301 |
| Molecular Formula | O2NC6H3-1,2-(CN)2 |
| Molecular Weight | 173.13 |
| Purity | 99 |
| Density | 1.4±0.1 g/cm3 |
| Boiling Point | 389.9±37.0 °C at 760 mmHg |
| Melting Point | 142-144 °C (lit.) |
| Appearance | powder, crystals or chunks |
| Storage Condition | Keep the receptacle sealed, stored in a cool, dry |
| Application | 4-Nitrophthalonitrile is a biochemical reagent that can be used as a biological material or organic compound for life science-related research. |
| EINECS | 250-748-9 |
| HTC | 2926909090 |
| PubChem ID | 24859873 |
| MDL Number | MFCD00040301 |
| SMILES | [O-][N+](=O)c1ccc(C#N)c(c1)C#N |
| InChI | 1S/C8H3N3O2/c9-4-6-1-2-8(11(12)13)3-7(6)5-10/h1-3H |
| InChI Key | NTZMSBAAHBICLE-UHFFFAOYSA-N |
| Beilstein/REAXYS | 1877554 |
| NACRES Code | NA.47 |
| UNSPSC | 12171500 |
| Hazard Symbols | Transport |
| Risk Codes | R22 |
| Safety Description | 26-36 |
| MSDS | msds/6050_2_31643_49_9.pdf |
| Bioactivity | 4-Nitrophthalonitrile is a biochemical reagent that can be used as a biological material or organic compound for life science related research. Related Catalog Research Areas >> Others In Vitro Used as pharmaceutical intermediates. Benzoylthiophene is an allosteric enhancer (AE) of A1 adenosine receptor agonist activity. Chemical & Physical Properties Density 1.4±0.1 g/cm3 Boiling Point 389.9±37.0 °C at 760 mmHg Melting Point 142-144 °C(lit.) Molecular Formula C8H3N3O2 Molecular Weight 173.13 Flash Point 189.6±26.5 °C Exact Mass 173.022522 PSA 93.40000 LogP 0.39 Vapor Pressure 0.0±0.9 mmHg at 25°C Index of Refraction 1.602 InChIKey NTZMSBAAHBICLE-UHFFFAOYSA-N SMILES N#Cc1ccc([N+](=O)[O-])cc1C#N |
| Use of | 4-Nitrophthalonitrile is a biochemical reagent that can be used as a biological material or organic compound for life science related research. Properties Name 4-nitrobenzene-1,2-dicarbonitrile Synonym More Synonyms 4-Nitrophthalonitrile Biological Activity Description 4-Nitrophthalonitrile is a biochemical reagent that can be used as a biological material or organic compound for life science related research. Related Catalog Research Areas >> Others In Vitro Used as pharmaceutical intermediates. Benzoylthiophene is an allosteric enhancer (AE) of A1 adenosine receptor agonist activity. Chemical & Physical Properties Molecular Formula C8H3N3O2 Exact Mass 173.022522 PSA 93.40000 Index of Refraction 1.602 InChIKey NTZMSBAAHBICLE-UHFFFAOYSA-N |
| Tax Rebate | 9.0% |
| Supervision | None MFN tariff: 6.5% Ordinary tariff: 30.0% |
| Transport Info | Product name: Purity: 99.5% |
| MSDS Transport Info | Module 14. Shipping information 14.1 UN dangerous goods number European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.2 Names specified by the United Nations (UN) European Land Transport Dangerous Regulations: Non-dangerous goods IMDG Code: Non-dangerous goods International air transport dangerous goods regulations: non-dangerous goods 14.3 Transport hazard categories European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.4 Package group European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.5 Environmental hazards European Land Transport Dangerous Regulations: No International Maritime Transport Dangerous Regulations Maritime Pollutants: No International Air Transport Risk Regulations: No 14.6 Special reminder to users No data available The above information is believed to be correct, but is not all-inclusive and should be used as a guide only. The information in this document is based on our current knowledge and is Correct safety instructions apply to this product. This information does not represent a warranty as to the properties of this product. See reverse side of invoice or packing slip. |
| Related Products in Specialty Chemicals | ||
|---|---|---|
| 4-Nitrophenylhydrazine hydrochloride | 636-99-7 | 2A-9006045 |
| 4-Nitrophenylisocyanide | 2A-106046 | 2A-9006046 |
| 4-Nitrophenyloxamic acid | 103-94-6 | 2A-9006047 |
| 4-Nitrophenylsulfur pentafluoride | 2613-27-6 | 2A-0202176 |
| 4-Nitrophthalimide | 89-40-7 | 2A-9006049 |
| 4-Nitrosophenol | 104-91-6 | 2A-9006051 |
| 4-Nitrothioanisole | 701-57-5 | 2A-9006052 |
| 4-Nitrothiophenol | 1849-36-1 | 2A-9006053 |
| 4-N-Methylaminobenzoylglutamic acid zinc salt | 2A-106054 | 2A-9006054 |
| 4-n-Pentylbenzoic acid | 26311-45-5 | 2A-9006055 |
| Browse all Specialty Chemicals products » | ||
Phone:
630-322-8886
630-322-8887
Email:
Office Locations:
Chicago, IL, USA
San Francisco, CA, USA
EN
SDS