3-Chloro-4-methylbenzoic acid
- Product Name3-Chloro-4-methylbenzoic acid
- CAS5162-82-3
- CBNumberCB6158244
- MFC8H7ClO2
- MW170.59
- MDL NumberMFCD00045841
- MOL File5162-82-3.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 208 °C |
| Boiling point | 105-107 °C(Press: 6.5 Torr) |
| Density | 1.310±0.06 g/cm3(Predicted) |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | DMSO (Sparingly), Methanol (Slightly) |
| form | Solid |
| pka | 4.00±0.10(Predicted) |
| color | White to Off-White |
| InChI | InChI=1S/C8H7ClO2/c1-5-2-3-6(8(10)11)4-7(5)9/h2-4H,1H3,(H,10,11) |
| InChIKey | SDKUOEOJAXGCLU-UHFFFAOYSA-N |
| SMILES | C(O)(=O)C1=CC=C(C)C(Cl)=C1 |
| CAS DataBase Reference | 5162-82-3(CAS DataBase Reference) |
| NIST Chemistry Reference | P-toluic acid, 3-chloro-(5162-82-3) |
Safety
| Symbol(GHS) |
|
|||||||||
| Signal word | Warning | |||||||||
| Hazard statements | H315-H319-H335 | |||||||||
| Precautionary statements | P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P261-P280a-P304+P340-P305+P351+P338-P405-P501a | |||||||||
| Hazard Codes | Xi,Xn | |||||||||
| Risk Statements | 36/37/38-51-41-37/38-22 | |||||||||
| Safety Statements | 26-37/39-39 | |||||||||
| RTECS | XU1650000 | |||||||||
| HazardClass | IRRITANT | |||||||||
| HS Code | 2916399090 | |||||||||
| NFPA 704: |
|
