114253-85-9
114253-85-9 structure
- Name: 4-(2H)Hydroxy-4-(2H3)methyl(2H8)pentan-2-one
- Chemical Name: 1,1,1,3,3,5,5,5-octadeuterio-4-deuteriooxy-4-(trideuteriomethyl)pentan-2-one
- CAS Number: 114253-85-9
- Molecular Formula: C6D12O2
- Molecular Weight: 128.232
- Create Date: 2018-06-22 00:45:35
- Modify Date: 2024-01-05 11:57:19
| Name | 1,1,1,3,3,5,5,5-octadeuterio-4-deuteriooxy-4-(trideuteriomethyl)pentan-2-one |
|---|---|
| Synonyms |
d12-4-hydroxy-4-methyl-2-pentanone
Octadeuterio-4-deuteriooxy-4-trideuteriomethyl-pentan-2-on Diacetone alcohol-d12 2-Pentanone-1,1,1,3,3,5,5,5-d, 4-(hydroxy-d)-4-(methyl-d)- 4-(H)Hydroxy-4-(H)methyl-2-(H)pentanone 4-(H)Hydroxy-4-(H)methyl(H)pentan-2-one 4-Hydroxy-4-methyl-2-pentanone-d12 octadeuterio-4-deuteriooxy-4-trideuteriomethyl-pentan-2-one MFCD00190463 |
| Density | 0.9±0.1 g/cm3 |
|---|---|
| Boiling Point | 168.1±0.0 °C at 760 mmHg |
| Molecular Formula | C6D12O2 |
| Molecular Weight | 128.232 |
| Flash Point | 61.7±0.0 °C |
| Exact Mass | 128.159058 |
| PSA | 37.30000 |
| LogP | -0.09 |
| Vapour Pressure | 0.5±0.6 mmHg at 25°C |
| Index of Refraction | 1.427 |
| Symbol |
GHS02, GHS07 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H226-H319 |
| Precautionary Statements | P210-P305 + P351 + P338-P370 + P378 |
| Hazard Codes | Xi: Irritant; |
| Risk Phrases | 36/37/38 |
| Safety Phrases | 26-36/37/39 |
| RIDADR | UN1148 - class 3 - PG 3 - Diacetone alcohol |
|
~%
114253-85-9 |
| Literature: Vassilikogiannakis, Georgios; Stratakis, Manolis; Orfanopoulos, Michael; Foote, Christopher S. Journal of Organic Chemistry, 1999 , vol. 64, # 11 p. 4130 - 4139 |
| Precursor 1 | |
|---|---|
| DownStream 2 | |
