2-(2,4-Difluorophenyl)acetonitrile
2-(2,4-Difluorophenyl)acetonitrile structure
|
Common Name | 2-(2,4-Difluorophenyl)acetonitrile | ||
|---|---|---|---|---|
| CAS Number | 656-35-9 | Molecular Weight | 153.129 | |
| Density | 1.2±0.1 g/cm3 | Boiling Point | 216.1±25.0 °C at 760 mmHg | |
| Molecular Formula | C8H5F2N | Melting Point | N/A | |
| MSDS | Chinese USA | Flash Point | 93.3±0.0 °C | |
| Symbol |
GHS07 |
Signal Word | Warning | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 2,4-Difluorophenylacetonitrile |
|---|---|
| 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.
| Density | 1.2±0.1 g/cm3 |
|---|---|
| Boiling Point | 216.1±25.0 °C at 760 mmHg |
| Molecular Formula | C8H5F2N |
| Molecular Weight | 153.129 |
| Flash Point | 93.3±0.0 °C |
| Exact Mass | 153.039001 |
| PSA | 23.79000 |
| LogP | 1.59 |
| Vapour Pressure | 0.1±0.4 mmHg at 25°C |
| Index of Refraction | 1.487 |
| InChIKey | AGAOESUOSOGZOD-UHFFFAOYSA-N |
| SMILES | N#CCc1ccc(F)cc1F |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Symbol |
GHS07 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H302 + H312 + H332-H315-H319-H335 |
| Precautionary Statements | P261-P280-P305 + P351 + P338 |
| Personal Protective Equipment | Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
| Hazard Codes | Xn:Harmful; |
| Risk Phrases | R20/21/22;R36/37/38 |
| Safety Phrases | S26-S36/37 |
| RIDADR | 3276 |
| WGK Germany | 3 |
| Packaging Group | III |
| Hazard Class | 6.1 |
| HS Code | 2926909090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
|
~%
2-(2,4-Difluoro... CAS#:656-35-9 |
| Literature: Ind. chim. belge Sonderband 31. Congr. int. chim. ind. Luettich 1958 Bd. 2, S. 466 |
|
~%
2-(2,4-Difluoro... CAS#:656-35-9 |
| Literature: Bulletin des Societes Chimiques Belges, , vol. 69, p. 312 - 322 |
|
~%
2-(2,4-Difluoro... CAS#:656-35-9 |
| Literature: Bulletin des Societes Chimiques Belges, , vol. 69, p. 312 - 322 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 4 | |
|---|---|
| DownStream 4 | |
CAS#:2647-30-5
CAS#:134672-72-3
CAS#:920501-68-4
CAS#:474709-81-4This 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 lists relevant public references with title, journal and publication metadata for this compound.
|
Synthesis of novel inhibitors of the HIV-1 protease: difunctional enols of simple N-protected amino acids.
Bioorg. Med. Chem. 2(5) , 343-55, (1994) A series of enol HIV-1 protease inhibitors which show competitive inhibition and the structure-activity relationship study which led to the design of these compounds are reported. By systematically mo... |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| EINECS 211-514-1 |
| 2,4-Difluorophenylacetonitrile |
| 2,4-Difluorobenzyl cyanide |
| 2,4-Difluorobenzeneacetonitrile |
| NC1R BF DF |
| (2,4-Difluorophenyl)acetonitrile |
| MFCD00009971 |
| 2-(2,4-difluorophenyl)acetonitrile |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the InChIKey of 2,4-Difluorophenylacetonitrile? |
| A: InChIKey of 2,4-Difluorophenylacetonitrile is AGAOESUOSOGZOD-UHFFFAOYSA-N. |
| Q: What is the molecular formula of 2,4-Difluorophenylacetonitrile? |
| A: Molecular formula of 2,4-Difluorophenylacetonitrile is C8H5F2N. |
| Q: What are the downstream products of 2,4-Difluorophenylacetonitrile? |
| A: Related downstream products(CAS) of 2,4-Difluorophenylacetonitrile: 2647-30-5;134672-72-3;920501-68-4;474709-81-4. |
| Q: What is the safety information for 2,4-Difluorophenylacetonitrile? |
| A: Safety information for 2,4-Difluorophenylacetonitrile: S26-S36/37. |
| Q: What English synonyms does 2,4-Difluorophenylacetonitrile have? |
| A: English synonyms of 2,4-Difluorophenylacetonitrile: EINECS 211-514-1, 2,4-Difluorophenylacetonitrile, 2,4-Difluorobenzyl cyanide, 2,4-Difluorobenzeneacetonitrile, NC1R BF DF, (2,4-Difluorophenyl)acetonitrile, MFCD00009971, 2-(2,4-difluorophenyl)acetonitrile. |
| Q: What is the polar surface area (PSA) of 2,4-Difluorophenylacetonitrile? |
| A: Polar surface area (PSA) of 2,4-Difluorophenylacetonitrile is 23.79000. |
| Q: What is the LogP of 2,4-Difluorophenylacetonitrile? |
| A: LogP of 2,4-Difluorophenylacetonitrile is 1.59. |
| Q: What are the upstream materials of 2,4-Difluorophenylacetonitrile? |
| A: Related upstream materials(CAS) of 2,4-Difluorophenylacetonitrile: 452-76-6;367-29-3;452-07-3;143-33-9. |
| Q: What is the English name of 2,4-Difluorophenylacetonitrile? |
| A: The English name of 2,4-Difluorophenylacetonitrile is 2,4-Difluorophenylacetonitrile. |
| Q: What is the molecular weight of 2,4-Difluorophenylacetonitrile? |
| A: Molecular weight of 2,4-Difluorophenylacetonitrile is 153.129. |
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. |