2,2-Diethyl-1,3-propanediol
- Product Name2,2-Diethyl-1,3-propanediol
- CAS115-76-4
- CBNumberCB1381560
- MFC7H16O2
- MW132.2
- EINECS204-103-3
- MDL NumberMFCD00004695
- MOL File115-76-4.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 59-61 °C(lit.) |
| Boiling point | 160 °C (50 mmHg) |
| Density | 0.9500 |
| refractive index | 1.4574 |
| Flash point | 102 °C |
| pka | 14.52±0.10(Predicted) |
| form | solid |
| color | Colorless to off-white |
| Henry's Law Constant | 2.0×104 mol/(m3Pa) at 25℃, Saxena and Hildemann (1996) |
| InChI | 1S/C7H16O2/c1-3-7(4-2,5-8)6-9/h8-9H,3-6H2,1-2H3 |
| InChIKey | XRVCFZPJAHWYTB-UHFFFAOYSA-N |
| SMILES | CCC(CC)(CO)CO |
| CAS DataBase Reference | 115-76-4(CAS DataBase Reference) |
| FDA UNII | A40PF8120T |
| UNSPSC Code | 12352100 |
Safety
| Symbol(GHS) |
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| Signal word | Warning | |||||||||
| Hazard statements | H302-H319 | |||||||||
| Precautionary statements | P264-P270-P280-P301+P312-P305+P351+P338-P337+P313 | |||||||||
| Hazard Codes | Xn | |||||||||
| Risk Statements | 22-36 | |||||||||
| Safety Statements | 26 | |||||||||
| WGK Germany | 2 | |||||||||
| RTECS | TY5250000 | |||||||||
| Storage Class | 11 - Combustible Solids | |||||||||
| Hazard Classifications | Acute Tox. 4 Oral Eye Irrit. 2 | |||||||||
| NFPA 704: |
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