2-(1,3-Dioxoisoindolin-2-yl)acetonitrile
2-(1,3-Dioxoisoindolin-2-yl)acetonitrile structure
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Common Name | 2-(1,3-Dioxoisoindolin-2-yl)acetonitrile | ||
|---|---|---|---|---|
| CAS Number | 3842-20-4 | Molecular Weight | 186.16700 | |
| Density | N/A | Boiling Point | 361.4°C at 760 mmHg | |
| Molecular Formula | C10H6N2O2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 2-(1,3-dioxoisoindol-2-yl)acetonitrile |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Boiling Point | 361.4°C at 760 mmHg |
|---|---|
| Molecular Formula | C10H6N2O2 |
| Molecular Weight | 186.16700 |
| Exact Mass | 186.04300 |
| PSA | 61.17000 |
| LogP | 0.74408 |
| InChIKey | KJTIDLYAIIARFO-UHFFFAOYSA-N |
| SMILES | N#CCN1C(=O)c2ccccc2C1=O |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Hazard Codes | Xi |
|---|---|
| HS Code | 2926909090 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 0 | |
|---|---|
| DownStream 3 | |
CAS#:4702-13-0
CAS#:3566-61-8
CAS#:121900-47-8This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2926909090 |
|---|---|
| Summary | HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0% |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Discovery of Small Molecules to Inhibit Human Cytomegalovirus Nuclear Egress
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
Target: HCMV UL50
External Id: HMS1262
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Name: Chemical Probes of Kaposi's Sarcoma Herpes Virus Latent Infection
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
Target: ORF 73 [Human herpesvirus 8 type M]
External Id: HMS791
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Name: NCI human tumor cell line growth inhibition assay. Data for the MCF7 Non-Small Cell L...
Source: DTP/NCI
Target: N/A
External Id: MCF7_OneDose
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Name: High-throughput screen for inhibitors of the GIV GBA-motif interaction with Galpha-i ...
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
External Id: HMS1303
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Name: A screen for compounds that inhibit the activity of LtaS in Staphylococcus aureus
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
External Id: HMS979
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|
Name: A screen for compounds that inhibit viral RNA polymerase binding and polymerization a...
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
Target: Chain A, Poliovirus Polymerase With Gtp
External Id: HMS750
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 1,3-dihydro-1,3-dioxo-2H-isoindole-2-acetonitrile |
| N-Cyanomethyl phthalimide |
| phthalimidoacetonitrile |
| N,N-Phthaloyl-glycin-nitril |
| N,N-phthaloyl-glycine nitrile |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the polar surface area (PSA) of 2-(1,3-dioxoisoindol-2-yl)acetonitrile? |
| A: Polar surface area (PSA) of 2-(1,3-dioxoisoindol-2-yl)acetonitrile is 61.17000. |
| Q: What is the InChIKey of 2-(1,3-dioxoisoindol-2-yl)acetonitrile? |
| A: InChIKey of 2-(1,3-dioxoisoindol-2-yl)acetonitrile is KJTIDLYAIIARFO-UHFFFAOYSA-N. |
| Q: What English synonyms does 2-(1,3-dioxoisoindol-2-yl)acetonitrile have? |
| A: English synonyms of 2-(1,3-dioxoisoindol-2-yl)acetonitrile: 1,3-dihydro-1,3-dioxo-2H-isoindole-2-acetonitrile, N-Cyanomethyl phthalimide, phthalimidoacetonitrile, N,N-Phthaloyl-glycin-nitril, N,N-phthaloyl-glycine nitrile. |
| Q: What are the downstream products of 2-(1,3-dioxoisoindol-2-yl)acetonitrile? |
| A: Related downstream products(CAS) of 2-(1,3-dioxoisoindol-2-yl)acetonitrile: 4702-13-0;3566-61-8;121900-47-8. |
| Q: What is the molecular weight of 2-(1,3-dioxoisoindol-2-yl)acetonitrile? |
| A: Molecular weight of 2-(1,3-dioxoisoindol-2-yl)acetonitrile is 186.16700. |
| Q: What is the English name of 2-(1,3-dioxoisoindol-2-yl)acetonitrile? |
| A: The English name of 2-(1,3-dioxoisoindol-2-yl)acetonitrile is 2-(1,3-dioxoisoindol-2-yl)acetonitrile. |
| Q: What is the LogP of 2-(1,3-dioxoisoindol-2-yl)acetonitrile? |
| A: LogP of 2-(1,3-dioxoisoindol-2-yl)acetonitrile is 0.74408. |
| Q: What is the boiling point of 2-(1,3-dioxoisoindol-2-yl)acetonitrile? |
| A: Boiling point of 2-(1,3-dioxoisoindol-2-yl)acetonitrile is 361.4°C at 760 mmHg. |
| Q: What is the SMILES notation of 2-(1,3-dioxoisoindol-2-yl)acetonitrile? |
| A: SMILES notation of 2-(1,3-dioxoisoindol-2-yl)acetonitrile is N#CCN1C(=O)c2ccccc2C1=O. |
| Q: What is the molecular formula of 2-(1,3-dioxoisoindol-2-yl)acetonitrile? |
| A: Molecular formula of 2-(1,3-dioxoisoindol-2-yl)acetonitrile is C10H6N2O2. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |