3-Bromo-4-methoxybenzonitrile
- Product Name3-Bromo-4-methoxybenzonitrile
- CAS117572-79-9
- CBNumberCB5139596
- MFC8H6BrNO
- MW212.04
- EINECS601-486-2
- MDL NumberMFCD00143097
- MOL File117572-79-9.mol
Chemical Properties
| Melting point: | 122-124 °C (lit.) |
| Boiling point: | 282.8±20.0 °C(Predicted) |
| Density | 1.56±0.1 g/cm3(Predicted) |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | Soluble in methanol. |
| form | powder to crystal |
| color | White to Light yellow to Light orange |
| BRN | 3246576 |
| InChI | 1S/C8H6BrNO/c1-11-8-3-2-6(5-10)4-7(8)9/h2-4H,1H3 |
| InChIKey | QHWZMDRKTYTPEE-UHFFFAOYSA-N |
| SMILES | COc1ccc(cc1Br)C#N |
| CAS DataBase Reference | 117572-79-9(CAS DataBase Reference) |
Safety
| Symbol(GHS) |
  GHS06,GHS07 |
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| Signal word | Warning | |||||||||
| Hazard statements | H301-H312+H332-H331-H302-H312-H315-H319-H332-H335 | |||||||||
| Precautionary statements | P261-P280-P305+P351+P338-P304+P340-P501a-P264-P270-P271-P301+P310+P330-P302+P352+P312+P362+P364-P304+P340+P312-P305+P351+P338+P337+P313-P405-P501 | |||||||||
| target organs | Respiratory system | |||||||||
| PPE | dust mask type N95 (US), Eyeshields, Gloves | |||||||||
| Hazard Codes | Xn,Xi | |||||||||
| Risk Statements | 20/21/22-36/37/38-52 | |||||||||
| Safety Statements | 26-36 | |||||||||
| RIDADR | 3439 | |||||||||
| WGK Germany | 3 | |||||||||
| Hazard Note | Harmful/Irritant | |||||||||
| HazardClass | 6.1 | |||||||||
| PackingGroup | III | |||||||||
| HS Code | 2926909090 | |||||||||
| Storage Class | 11 - Combustible Solids | |||||||||
| Hazard Classifications |
Acute Tox. 4 Dermal Acute Tox. 4 Inhalation Acute Tox. 4 Oral Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
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| Limited Quantities | 5.0 kg (11 lbs) (solid) | |||||||||
| Excepted Quantities | Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L) | |||||||||
| NFPA 704: |
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