2-Bromotoluene
2-Bromotoluene structure
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Common Name | 2-Bromotoluene | ||
|---|---|---|---|---|
| CAS Number | 95-46-5 | Molecular Weight | 171.035 | |
| Density | 1.4±0.1 g/cm3 | Boiling Point | 180.8±9.0 °C at 760 mmHg | |
| Molecular Formula | C7H7Br | Melting Point | -27 °C | |
| MSDS | Chinese USA | Flash Point | 78.9±0.0 °C | |
| Symbol |
GHS07 |
Signal Word | Warning | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 2-Bromotoluene |
|---|---|
| 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 | 1.4±0.1 g/cm3 |
|---|---|
| Boiling Point | 180.8±9.0 °C at 760 mmHg |
| Melting Point | -27 °C |
| Molecular Formula | C7H7Br |
| Molecular Weight | 171.035 |
| Flash Point | 78.9±0.0 °C |
| Exact Mass | 169.973099 |
| LogP | 3.45 |
| Vapour Pressure | 1.2±0.3 mmHg at 25°C |
| Index of Refraction | 1.549 |
| InChIKey | QSSXJPIWXQTSIX-UHFFFAOYSA-N |
| SMILES | Cc1ccccc1Br |
| Stability | Stable. Incompatible with strong oxidizing agents. |
| Water Solubility | <0.1 g/100 mL at 15 ºC |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table summarizes toxicological test data, acute & chronic toxicity and ecological hazard parameters for this chemical.
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATAACUTE TOXICITY DATA
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This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Symbol |
GHS07 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H302-H315-H319-H335 |
| Precautionary Statements | P261-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 | R22;R36/37/38 |
| Safety Phrases | S36/37/39-S37/39-S26 |
| WGK Germany | 3 |
| RTECS | XS7965500 |
| Packaging Group | I; II; III |
| Hazard Class | 6.1 |
| HS Code | 29036990 |
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#:103-73-1
CAS#:2093-46-1
CAS#:333-27-7
CAS#:583-53-9
CAS#:108-88-3
CAS#:615-37-2
CAS#:124-38-9
CAS#:61563-25-5
CAS#:3433-80-5![2,2-dimethylpropane-1,3-diyl [2-bromophenyl] boronate Structure](https://image.chemsrc.com/caspic/112/884010-16-6.png)
CAS#:884010-16-6
CAS#:1075-28-1
CAS#:1074-92-6
CAS#:104847-07-6
CAS#:104750-61-0
CAS#:41064-50-0
CAS#:527-85-5
CAS#:5931-53-3![2'-METHYL-[1,1'-BIPHENYL]-4-CARBOXYLIC ACID structure](https://image.chemsrc.com/caspic/035/5748-43-6.png)
CAS#:5748-43-6
CAS#:52711-30-5
CAS#:39512-51-1This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2903999090 |
|---|---|
| Summary | 2903999090 halogenated derivatives of aromatic hydrocarbons VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0% |
This table lists relevant public references with title, journal and publication metadata for this compound.
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Vibrational spectroscopic analysis of 2-chlorotoluene and 2-bromotoluene: A combined experimental and theoretical study
Spectrochim. Acta. A. Mol. Biomol. Spectrosc. 77(5) , 1005-13, (2010) In this work, the vibrational spectral analysis was carried out using Raman and infrared spectroscopy in the range 100–4000 cm −1 and 50–4000 cm −1, respectively, for the title molecules. The molecula... |
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Tetraphosphine/palladium-catalysed Suzuki cross-coupling with sterically hindered aryl bromides and arylboronic acids. Feuerstein M, et al.
Tetrahedron Lett. 42(38) , 6667-70, (2001)
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Synthetic studies on arene-olefin cycloadditions. ii. total synthesis of (±)-isocomene. Wender PA and Geoffrey BD.
Tetrahedron 37(25) , 4445-50, (1981)
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| O-BROMOTOLUENE |
| o-Tolylbromide |
| 2-methylbromobenzene |
| bromotoluene |
| EINECS 202-421-7 |
| 2-bromo-1-methylbenzene |
| 2-Bromtoluol |
| 2-TOLYL BROMIDE |
| toluene,2-bromo |
| o-bromo-toluen |
| o-Tolyl bromide |
| MFCD00000068 |
| 1-Bromo-2-methylbenzene |
| 2-tolylbromide |
| ortho-bromotoluene |
| 2-bromo-toluen |
| 2-bromo toluene |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What are the downstream products of 2-Bromotoluene? |
| A: Related downstream products(CAS) of 2-Bromotoluene: 1075-28-1;1074-92-6;104847-07-6;104750-61-0;41064-50-0;527-85-5;5931-53-3;5748-43-6;52711-30-5;39512-51-1. |
| Q: What is the molecular weight of 2-Bromotoluene? |
| A: Molecular weight of 2-Bromotoluene is 171.035. |
| Q: What is the LogP of 2-Bromotoluene? |
| A: LogP of 2-Bromotoluene is 3.45. |
| Q: What is the melting point of 2-Bromotoluene? |
| A: Melting point of 2-Bromotoluene is -27 °C. |
| Q: What is the boiling point of 2-Bromotoluene? |
| A: Boiling point of 2-Bromotoluene is 180.8±9.0 °C at 760 mmHg. |
| Q: What is the InChIKey of 2-Bromotoluene? |
| A: InChIKey of 2-Bromotoluene is QSSXJPIWXQTSIX-UHFFFAOYSA-N. |
| Q: What is the SMILES notation of 2-Bromotoluene? |
| A: SMILES notation of 2-Bromotoluene is Cc1ccccc1Br. |
| Q: What English synonyms does 2-Bromotoluene have? |
| A: English synonyms of 2-Bromotoluene: O-BROMOTOLUENE, o-Tolylbromide, 2-methylbromobenzene, bromotoluene, EINECS 202-421-7, 2-bromo-1-methylbenzene, 2-Bromtoluol, 2-TOLYL BROMIDE, toluene,2-bromo, o-bromo-toluen, o-Tolyl bromide, MFCD00000068, 1-Bromo-2-methylbenzene, 2-tolylbromide, ortho-bromotoluene, 2-bromo-toluen, 2-bromo toluene. |
| Q: What are the upstream materials of 2-Bromotoluene? |
| A: Related upstream materials(CAS) of 2-Bromotoluene: 103-73-1;2093-46-1;333-27-7;583-53-9;108-88-3;615-37-2;124-38-9;61563-25-5;3433-80-5;884010-16-6. |
| Q: What is the safety information for 2-Bromotoluene? |
| A: Safety information for 2-Bromotoluene: S36/37/39-S37/39-S26. |
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. |