3,5,7-Trimethyladamantane-1-carboxylic acid
- Product Name3,5,7-Trimethyladamantane-1-carboxylic acid
- CAS15291-66-4
- CBNumberCB5100190
- MFC14H22O2
- MW222.32
- MDL NumberMFCD00187581
- MOL File15291-66-4.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 139-141 °C(Solv: ethanol (64-17-5); water (7732-18-5)) |
| Boiling point | 334.8±10.0 °C(Predicted) |
| Density | 1.165±0.06 g/cm3(Predicted) |
| pka | 4.89±0.70(Predicted) |
| form | solid |
| InChI | 1S/C14H22O2/c1-11-4-12(2)6-13(3,5-11)9-14(7-11,8-12)10(15)16/h4-9H2,1-3H3,(H,15,16)/t11-,12+,13-,14- |
| InChIKey | DHIIUPVOLLOORM-YXSUXZIUSA-N |
| SMILES | OC(C1(C[C@]23C)C[C@](C2)(C)C[C@](C3)(C)C1)=O |
| UNSPSC Code | 12352106 |
| NACRES | NA.21 |
Safety
| Symbol(GHS) |
|
| Signal word | Warning |
| Hazard statements | H319-H335-H315 |
| Precautionary statements | P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P |
| WGK Germany | WGK 3 |
| HazardClass | IRRITANT |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Oral |
