2-Fluorobenzonitrile
2-Fluorobenzonitrile structure
|
Common Name | 2-Fluorobenzonitrile | ||
|---|---|---|---|---|
| CAS Number | 394-47-8 | Molecular Weight | 121.112 | |
| Density | 1.2±0.1 g/cm3 | Boiling Point | 193.6±0.0 °C at 760 mmHg | |
| Molecular Formula | C7H4FN | Melting Point | 35 - 37ºC | |
| MSDS | Chinese USA | Flash Point | 73.9±0.0 °C | |
| Symbol |
GHS05, GHS07 |
Signal Word | Danger | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 2-Fluorobenzonitrile |
|---|---|
| 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 | 193.6±0.0 °C at 760 mmHg |
| Melting Point | 35 - 37ºC |
| Molecular Formula | C7H4FN |
| Molecular Weight | 121.112 |
| Flash Point | 73.9±0.0 °C |
| Exact Mass | 121.032776 |
| PSA | 23.79000 |
| LogP | 1.51 |
| Vapour Pressure | 0.5±0.3 mmHg at 25°C |
| Index of Refraction | 1.511 |
| InChIKey | GDHXJNRAJRCGMX-UHFFFAOYSA-N |
| SMILES | N#Cc1ccccc1F |
| Storage condition | Refrigerator |
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 |
GHS05, GHS07 |
|---|---|
| Signal Word | Danger |
| Hazard Statements | H302-H315-H318-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-S39-S36/37/39 |
| RIDADR | 3276 |
| WGK Germany | 3 |
| Packaging Group | III |
| HS Code | 29269095 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 10 | |
|---|---|
| DownStream 10 | |
CAS#:446-52-6
CAS#:873-32-5
CAS#:81175-49-7
CAS#:1193-82-4
CAS#:612-24-8
CAS#:348-51-6
CAS#:557-21-1
CAS#:2042-37-7
CAS#:395-46-0
CAS#:24652-66-2
CAS#:111982-45-7
CAS#:50907-19-2![Methyl 3-amino-2-benzo[b]furancarboxylate structure](https://image.chemsrc.com/caspic/269/57805-85-3.png)
CAS#:57805-85-3
CAS#:31915-26-1
CAS#:57075-81-7
CAS#:3430-40-8![Ethyl 3-aminobenzo[b]thiophene-2-carboxylate structure](https://image.chemsrc.com/caspic/446/34761-09-6.png)
CAS#:34761-09-6![Benzo[d]isoxazol-3-amine structure](https://image.chemsrc.com/caspic/057/36216-80-5.png)
CAS#:36216-80-5
CAS#:3759-28-2
CAS#:147531-47-3This 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.
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High-sensitivity elemental ionization for quantitative detection of halogenated compounds.
Analyst 140 , 8177-85, (2015) The rising importance of organohalogens in environmental, pharmaceutical, and biological applications has drawn attention to analysis of these compounds in recent years. Elemental mass spectrometry (M... |
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Studies on the synthetic compatibility of aryloxime linkers in the solid-phase synthesis of 3-aminobenzisoxazoles.
J. Org. Chem. 65(10) , 2924-32, (2000) Further exploration of the scope of our solid-phase method for the synthesis of 3-aminobenzisoxazoles (using the Kaiser oxime resin 1) is described. The effects of base, leaving group, and solvent on ... |
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Aminoborohydrides. 12. Novel tandem S(N)Ar amination-reduction reactions of 2-halobenzonitriles with lithium N,N-dialkylaminoborohydrides.
J. Org. Chem. 66(6) , 1999-2004, (2001) A novel tandem amination-reduction reaction has been developed in which 2-(N,N-dialkylamino)benzylamines are generated from 2-halobenzonitriles and lithium N,N-dialkylaminoborohydride (LAB) reagents. ... |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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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: NCI human tumor cell line growth inhibition assay. Data for the IGROV1 Non-Small Cell...
Source: DTP/NCI
Target: N/A
External Id: IGROV1_OneDose
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| NCR BF |
| Benzonitrile,o-fluoro |
| o-Fluorobenzonitrile |
| EINECS 206-897-7 |
| 2-Fluorobenzenenitrile |
| 1-CYANO-2-FLUOROBENZENE |
| o-Cyanofluorobenzene |
| Benzonitrile,2-fluoro |
| 2-Fluorobenzonitrile |
| 2-fluoro-benzonitrile |
| 2-Fluorobenzenecarbonitrile |
| MFCD00001773 |
| 2-FLUOROBENZONITRIL |
| 2-Cyanofluorobenzene |
| 2-fluorocyanobenzene |
| Letrozole Impurity 9 |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the boiling point of 2-Fluorobenzonitrile? |
| A: Boiling point of 2-Fluorobenzonitrile is 193.6±0.0 °C at 760 mmHg. |
| Q: What is the LogP of 2-Fluorobenzonitrile? |
| A: LogP of 2-Fluorobenzonitrile is 1.51. |
| Q: What is the safety information for 2-Fluorobenzonitrile? |
| A: Safety information for 2-Fluorobenzonitrile: S26-S39-S36/37/39. |
| Q: What is the English name of 2-Fluorobenzonitrile? |
| A: The English name of 2-Fluorobenzonitrile is 2-Fluorobenzonitrile. |
| Q: What are the storage conditions for 2-Fluorobenzonitrile? |
| A: Storage conditions for 2-Fluorobenzonitrile: Refrigerator. |
| Q: What is the molecular weight of 2-Fluorobenzonitrile? |
| A: Molecular weight of 2-Fluorobenzonitrile is 121.112. |
| Q: What are the upstream materials of 2-Fluorobenzonitrile? |
| A: Related upstream materials(CAS) of 2-Fluorobenzonitrile: 446-52-6;873-32-5;81175-49-7;1193-82-4;612-24-8;348-51-6;557-21-1;2042-37-7;395-46-0;24652-66-2. |
| Q: What is the CAS number of 2-Fluorobenzonitrile? |
| A: CAS number of 2-Fluorobenzonitrile is 394-47-8. |
| Q: What are the downstream products of 2-Fluorobenzonitrile? |
| A: Related downstream products(CAS) of 2-Fluorobenzonitrile: 111982-45-7;50907-19-2;57805-85-3;31915-26-1;57075-81-7;3430-40-8;34761-09-6;36216-80-5;3759-28-2;147531-47-3. |
| Q: What is the polar surface area (PSA) of 2-Fluorobenzonitrile? |
| A: Polar surface area (PSA) of 2-Fluorobenzonitrile is 23.79000. |
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. |
| Henan Tianfu Chemical Co., Ltd. |
| Zhongshan Xingrui Chemical Co. , Ltd. |
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- Shanghai Nianxing Industrial Co., Ltd
- China
- Product Name: 2-Fluorobenzonitrile
- Price: Check
- Purity: 99.0%
- Delivery: 10 Day
- Contact: Yang
- Email: sales@echemcloud.com
- Dayang Chem (Hangzhou) Co., Ltd.
- China
- Product Name: 2-Fluorobenzonitrile
- Price: $Inquiry/100g $Inquiry/1kg $Inquiry/100kg $Inquiry/1000kg
- Purity: 98.0%
- Delivery: Inquiry
- Contact: Ms Wang
- Email: enquiry@dycnchem.com
- Henan Tianfu Chemical Co., Ltd.
- China
- Product Name: 2-Fluorobenzonitrile
- Price: $Inquiry/1kg $Inquiry/25kg $Inquiry/1000kg $Inquiry/10ton
- Purity: 99.0%
- Delivery: Inquiry
- Contact: Anson
- Email: info@tianfuchem.com
- Zhongshan Xingrui Chemical Co. , Ltd.
- China
- Product Name: 2-Fluorobenzonitrile
- Price: ￥Inquiry/25kg
- Purity: 99.0%
- Delivery: Inquiry
- Contact: Wang Jie
- Email: 3096638339@qq.com
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