Introduction：Basic information about CAS 114253-85-9|4-(2H)Hydroxy-4-(2H3)methyl(2H8)pentan-2-one, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 4-(2H)Hydroxy-4-(2H3)methyl(2H8)pentan-2-one |
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| CAS Number | 114253-85-9 | Molecular Weight | 128.232 |
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| Density | 0.9±0.1 g/cm3 | Boiling Point | 168.1±0.0 °C at 760 mmHg |
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| Molecular Formula | C6D12O2 | Melting Point | / |
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| MSDS | ChineseUSA | Flash Point | 61.7±0.0 °C |
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| Symbol |
GHS02, GHS07 | Signal Word | Warning |
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Names
| Name | 1,1,1,3,3,5,5,5-octadeuterio-4-deuteriooxy-4-(trideuteriomethyl)pentan-2-one |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 0.9±0.1 g/cm3 |
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| Boiling Point | 168.1±0.0 °C at 760 mmHg |
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| Molecular Formula | C6D12O2 |
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| Molecular Weight | 128.232 |
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| Flash Point | 61.7±0.0 °C |
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| Exact Mass | 128.159058 |
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| PSA | 37.30000 |
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| LogP | -0.09 |
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| Vapour Pressure | 0.5±0.6 mmHg at 25°C |
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| Index of Refraction | 1.427 |
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| InChIKey | SWXVUIWOUIDPGS-YDUIPVTMSA-N |
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| SMILES | CC(=O)CC(C)(C)O |
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Safety Information
| Symbol |
GHS02, GHS07 |
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| Signal Word | Warning |
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| Hazard Statements | H226-H319 |
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| Precautionary Statements | P210-P305 + P351 + P338-P370 + P378 |
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| Hazard Codes | Xi: Irritant; |
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| Risk Phrases | 36/37/38 |
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| Safety Phrases | 26-36/37/39 |
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| RIDADR | UN1148 - class 3 - PG 3 - Diacetone alcohol |
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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 |
