trans-4-Pentylcyclohexanecarboxylic acid
- Product Nametrans-4-Pentylcyclohexanecarboxylic acid
- CAS38289-29-1
- CBNumberCB3478387
- MFC12H22O2
- MW198.3
- EINECS626-251-1
- MDL NumberMFCD00009964
- MOL File38289-29-1.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 51-53 °C (lit.) |
| Boiling point | 295.63°C (rough estimate) |
| Density | 0.9590 (rough estimate) |
| refractive index | 1.4720 (estimate) |
| Flash point | >230 °F |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | almost transparency in Methanol |
| form | powder to crystal |
| pka | 4.94±0.10(Predicted) |
| color | White to Almost white |
| InChI | 1S/C12H22O2/c1-2-3-4-5-10-6-8-11(9-7-10)12(13)14/h10-11H,2-9H2,1H3,(H,13,14)/t10-,11- |
| InChIKey | RVLAXPQGTRTHEV-XYPYZODXSA-N |
| SMILES | CCCCC[C@@H]1CC[C@H](CC1)C(O)=O |
| CAS DataBase Reference | 38289-29-1(CAS DataBase Reference) |
| EWG's Food Scores | 1 |
| FDA UNII | S86CWG6K6Q |
| UNSPSC Code | 12352100 |
| NACRES | NA.22 |
Safety
| Symbol(GHS) |
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| Signal word | Warning | |||||||||
| Hazard statements | H315-H319 | |||||||||
| Precautionary statements | P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+P313 | |||||||||
| Hazard Codes | Xi,Xn | |||||||||
| Risk Statements | 36/37/38-22 | |||||||||
| Safety Statements | 26-36-37/39 | |||||||||
| WGK Germany | 3 | |||||||||
| HS Code | 29162090 | |||||||||
| Storage Class | 11 - Combustible Solids | |||||||||
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 | |||||||||
| NFPA 704: |
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