3,4-Dimethylbromobenzene structure
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Common Name | 3,4-Dimethylbromobenzene | ||
|---|---|---|---|---|
| CAS Number | 583-71-1 | Molecular Weight | 185.061 | |
| Density | 1.3±0.1 g/cm3 | Boiling Point | 213.9±9.0 °C at 760 mmHg | |
| Molecular Formula | C8H9Br | Melting Point | −12-−10 °C | |
| MSDS | Chinese USA | Flash Point | 85.8±13.1 °C | |
| Symbol |
GHS07, GHS09 |
Signal Word | Warning | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 4-Bromo-1,2-dimethylbenzene |
|---|---|
| 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 | 1.3±0.1 g/cm3 |
|---|---|
| Boiling Point | 213.9±9.0 °C at 760 mmHg |
| Melting Point | −12-−10 °C |
| Molecular Formula | C8H9Br |
| Molecular Weight | 185.061 |
| Flash Point | 85.8±13.1 °C |
| Exact Mass | 183.988754 |
| LogP | 3.91 |
| Vapour Pressure | 0.2±0.4 mmHg at 25°C |
| Index of Refraction | 1.544 |
| InChIKey | QOGHRLGTXVMRLM-UHFFFAOYSA-N |
| SMILES | Cc1ccc(Br)cc1C |
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, GHS09 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H302-H315-H319-H335-H400 |
| Precautionary Statements | P261-P273-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 | Xi:Irritant |
| Risk Phrases | R22;R36/37/38;R50/53 |
| Safety Phrases | S26-S60-S61-S24/25 |
| RIDADR | UN 1701 6.1/PG 2 |
| WGK Germany | 3 |
| RTECS | CY9020400 |
| 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.
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~98%
3,4-Dimethylbro... CAS#:583-71-1 |
| Literature: Tetrahedron, , vol. 53, # 7 p. 2581 - 2584 |
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~24%
3,4-Dimethylbro... CAS#:583-71-1
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| Literature: Russian Journal of Organic Chemistry, , vol. 41, # 11 p. 1631 - 1636 |
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~10%
3,4-Dimethylbro... CAS#:583-71-1
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| Literature: Tetrahedron Letters, , vol. 48, # 18 p. 3247 - 3250 |
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~3%
3,4-Dimethylbro... CAS#:583-71-1
Detail
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| Literature: Journal of Organic Chemistry, , vol. 62, # 2 p. 236 - 237 |
|
~28%
3,4-Dimethylbro... CAS#:583-71-1 |
| Literature: Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999), , # 4 p. 775 - 780 |
|
~%
3,4-Dimethylbro... CAS#:583-71-1 |
| Literature: Monatshefte fuer Chemie, , vol. 64, p. 361,364, 365 Monatshefte fuer Chemie, , vol. 65, p. 6,14 Journal of the Chemical Society, , p. 505,510 |
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~%
3,4-Dimethylbro... CAS#:583-71-1 |
| Literature: Journal of the Indian Chemical Society, , vol. 16, p. 460 |
|
~%
3,4-Dimethylbro... CAS#:583-71-1 |
| Literature: Chemische Berichte, , vol. 71, p. 684,687 |
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~%
3,4-Dimethylbro... CAS#:583-71-1
Detail
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| Literature: Chemische Berichte, , vol. 17, p. 2374 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 7 | |
|---|---|
| DownStream 10 | |
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 29036990 |
|---|
This table lists relevant public references with title, journal and publication metadata for this compound.
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[Mechanism of disorders of reproductive function after exposure to 4-brom-o-xylol (experimental studies)].
Gig. Tr. Prof. Zabol. (3) , 48-9, (1989)
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[Significance of morphofunctional assessment of tissue basophil reactions in prognostication of harmful effects of chemical substances].
Gig. Tr. Prof. Zabol. (5) , 23-5, (1991) The article contains a comparative analysis of experimental data on the assessment of the general toxicological, gonadotrophic effects and morphofunctional reactions of tissue basophils under the infl... |
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Vibrational spectroscopic studies and DFT calculations of 4-bromo-o-xylene.
Spectrochim. Acta. A. Mol. Biomol. Spectrosc. 91 , 419-30, (2012) In the present work, we reported a combined experimental and theoretical study on molecular structure, vibrational spectra and NBO analysis of 4-bromo-o-xylene (BOX). The FT-IR (400-4000 cm(-1)) and F... |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| EINECS 209-518-3 |
| 3,4-Dimethylbromobenzene |
| 4-Bromo-o-xylene |
| 4-Bromo-1,2-dimethylbenzene |
| MFCD00000086 |
| ER C1 D1 |
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 4-Bromo-1,2-dimethylbenzene? |
| A: Related downstream products(CAS) of 4-Bromo-1,2-dimethylbenzene: 63114-76-1;105336-21-8;103323-56-4;105336-41-2;105336-40-1;4920-95-0;38404-42-1;55499-43-9;55389-75-8;95-65-8. |
| Q: What is the English name of 4-Bromo-1,2-dimethylbenzene? |
| A: The English name of 4-Bromo-1,2-dimethylbenzene is 4-Bromo-1,2-dimethylbenzene. |
| Q: What is the molecular weight of 4-Bromo-1,2-dimethylbenzene? |
| A: Molecular weight of 4-Bromo-1,2-dimethylbenzene is 185.061. |
| Q: What are the upstream materials of 4-Bromo-1,2-dimethylbenzene? |
| A: Related upstream materials(CAS) of 4-Bromo-1,2-dimethylbenzene: 95-47-6;593-53-3;106-38-7;95-64-7;618-01-9;7726-95-6;7553-56-2. |
| Q: What is the LogP of 4-Bromo-1,2-dimethylbenzene? |
| A: LogP of 4-Bromo-1,2-dimethylbenzene is 3.91. |
| Q: What is the safety information for 4-Bromo-1,2-dimethylbenzene? |
| A: Safety information for 4-Bromo-1,2-dimethylbenzene: S26-S60-S61-S24/25. |
| Q: What is the InChIKey of 4-Bromo-1,2-dimethylbenzene? |
| A: InChIKey of 4-Bromo-1,2-dimethylbenzene is QOGHRLGTXVMRLM-UHFFFAOYSA-N. |
| Q: What is the SMILES notation of 4-Bromo-1,2-dimethylbenzene? |
| A: SMILES notation of 4-Bromo-1,2-dimethylbenzene is Cc1ccc(Br)cc1C. |
| Q: What is the melting point of 4-Bromo-1,2-dimethylbenzene? |
| A: Melting point of 4-Bromo-1,2-dimethylbenzene is −12-−10 °C. |
| Q: What English synonyms does 4-Bromo-1,2-dimethylbenzene have? |
| A: English synonyms of 4-Bromo-1,2-dimethylbenzene: EINECS 209-518-3, 3,4-Dimethylbromobenzene, 4-Bromo-o-xylene, 4-Bromo-1,2-dimethylbenzene, MFCD00000086, ER C1 D1. |
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. |