2-bromo-4-cyanophenol
2-bromo-4-cyanophenol structure
|
Common Name | 2-bromo-4-cyanophenol | ||
|---|---|---|---|---|
| CAS Number | 2315-86-8 | Molecular Weight | 198.017 | |
| Density | 1.8±0.1 g/cm3 | Boiling Point | 271.1±25.0 °C at 760 mmHg | |
| Molecular Formula | C7H4BrNO | Melting Point | 155-159 °C(lit.) | |
| MSDS | Chinese USA | Flash Point | 117.8±23.2 °C | |
| Symbol |
GHS07 |
Signal Word | Warning | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 3-bromo-4-hydroxybenzonitrile |
|---|---|
| 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 | 1.8±0.1 g/cm3 |
|---|---|
| Boiling Point | 271.1±25.0 °C at 760 mmHg |
| Melting Point | 155-159 °C(lit.) |
| Molecular Formula | C7H4BrNO |
| Molecular Weight | 198.017 |
| Flash Point | 117.8±23.2 °C |
| Exact Mass | 196.947617 |
| PSA | 44.02000 |
| LogP | 2.30 |
| Vapour Pressure | 0.0±0.6 mmHg at 25°C |
| Index of Refraction | 1.656 |
| InChIKey | HLHNOIAOWQFNGW-UHFFFAOYSA-N |
| SMILES | N#Cc1ccc(O)c(Br)c1 |
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 |
| Personal Protective Equipment | dust mask type N95 (US);Eyeshields;Gloves |
| Hazard Codes | Xn:Harmful; |
| Risk Phrases | R20/21/22 |
| Safety Phrases | 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.
|
~93%
2-bromo-4-cyano... CAS#:2315-86-8 |
| Literature: CHEMO IBERICA, S.A.; CASTALDI, Graziano; RASPARINI, Marcello; SILLANI, Laura Patent: WO2010/142653 A1, 2010 ; Location in patent: Page/Page column 14 ; |
|
~83%
2-bromo-4-cyano... CAS#:2315-86-8 |
| Literature: Denton, Ross M.; An, Jie; Lindovska, Petra; Lewis, William Tetrahedron, 2012 , vol. 68, # 13 p. 2899 - 2905 |
|
~69%
2-bromo-4-cyano... CAS#:2315-86-8 |
| Literature: NATCO PHARMA LIMITED; Kompella, Amala; Gampa, Venue Gopala Krishna; Adibhatla, Kali Satya Bhujanga Rao; Nannapaneni, Venkaiah Chowdary Patent: US2013/172571 A1, 2013 ; Location in patent: Paragraph 0085; 0086; 0087; 0088 ; |
|
~92%
2-bromo-4-cyano... CAS#:2315-86-8 |
| Literature: Chinnagolla, Ravi Kiran; Pimparkar, Sandeep; Jeganmohan, Masilamani Chemical Communications, 2013 , vol. 49, # 30 p. 3146 - 3148 |
|
~%
2-bromo-4-cyano... CAS#:2315-86-8
Learn More
|
| Literature: Journal of Organic Chemistry, , vol. 62, p. 4504 - 4506 |
|
~%
2-bromo-4-cyano... CAS#:2315-86-8 |
| Literature: Chemische Berichte, , vol. 29, p. 2357 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 2 | |
|---|---|
| DownStream 9 | |
CAS#:208665-95-6
CAS#:117572-79-9
CAS#:3336-26-3
CAS#:160844-75-7
CAS#:144060-96-8
CAS#:161718-81-6
CAS#:163597-57-7
CAS#:79008-77-8This 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 collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 3-Bromo-4-hydroxy-benzonitrile |
| 3-Brom-4-hydroxy-benzonitril |
| 3-Bromo-4-hydroxybenzonitrile |
| 3-bromo-4-hydroxybenzenecarbonitrile |
| 2-bromo-4-cyanophenol |
| MFCD00143096 |
| 3-bromo-4-hydroxylbenzonitrile |
| 3-Brom-4-hydroxy-benzoesaeure-nitril |
| 2-Brom-4-cyan-phenol |
| EINECS 219-022-9 |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the LogP of 3-bromo-4-hydroxybenzonitrile? |
| A: LogP of 3-bromo-4-hydroxybenzonitrile is 2.30. |
| Q: What is the safety information for 3-bromo-4-hydroxybenzonitrile? |
| A: Safety information for 3-bromo-4-hydroxybenzonitrile: S36/37. |
| Q: What is the boiling point of 3-bromo-4-hydroxybenzonitrile? |
| A: Boiling point of 3-bromo-4-hydroxybenzonitrile is 271.1±25.0 °C at 760 mmHg. |
| Q: What is the molecular weight of 3-bromo-4-hydroxybenzonitrile? |
| A: Molecular weight of 3-bromo-4-hydroxybenzonitrile is 198.017. |
| Q: What English synonyms does 3-bromo-4-hydroxybenzonitrile have? |
| A: English synonyms of 3-bromo-4-hydroxybenzonitrile: 3-Bromo-4-hydroxy-benzonitrile, 3-Brom-4-hydroxy-benzonitril, 3-Bromo-4-hydroxybenzonitrile, 3-bromo-4-hydroxybenzenecarbonitrile, 2-bromo-4-cyanophenol, MFCD00143096, 3-bromo-4-hydroxylbenzonitrile, 3-Brom-4-hydroxy-benzoesaeure-nitril, 2-Brom-4-cyan-phenol, EINECS 219-022-9. |
| Q: What is the InChIKey of 3-bromo-4-hydroxybenzonitrile? |
| A: InChIKey of 3-bromo-4-hydroxybenzonitrile is HLHNOIAOWQFNGW-UHFFFAOYSA-N. |
| Q: What is the SMILES notation of 3-bromo-4-hydroxybenzonitrile? |
| A: SMILES notation of 3-bromo-4-hydroxybenzonitrile is N#Cc1ccc(O)c(Br)c1. |
| Q: What is the English name of 3-bromo-4-hydroxybenzonitrile? |
| A: The English name of 3-bromo-4-hydroxybenzonitrile is 3-bromo-4-hydroxybenzonitrile. |
| Q: What is the melting point of 3-bromo-4-hydroxybenzonitrile? |
| A: Melting point of 3-bromo-4-hydroxybenzonitrile is 155-159 °C(lit.). |
| Q: What are the downstream products of 3-bromo-4-hydroxybenzonitrile? |
| A: Related downstream products(CAS) of 3-bromo-4-hydroxybenzonitrile: 208665-95-6;117572-79-9;3336-26-3;160844-75-7;144060-96-8;2973-78-6;161718-81-6;163597-57-7;79008-77-8. |
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. |