Introduction：Basic information about CAS 115871-50-6|Pentanoic Acid-d9, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Pentanoic Acid-d9 |
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| CAS Number | 115871-50-6 | Molecular Weight | 111.18700 |
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| Density | 1.022 g/mL at 25ºC | Boiling Point | 185ºC(lit.) |
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| Molecular Formula | C5HD9O2 | Melting Point | -20--18ºC(lit.) |
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| MSDS | ChineseUSA | Flash Point | 192 °F |
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| Symbol |
GHS05, GHS07 | Signal Word | Danger |
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Names
| Name | 2,2,3,3,4,4,5,5,5-nonadeuteriopentanoic acid |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.022 g/mL at 25ºC |
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| Boiling Point | 185ºC(lit.) |
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| Melting Point | -20--18ºC(lit.) |
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| Molecular Formula | C5HD9O2 |
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| Molecular Weight | 111.18700 |
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| Flash Point | 192 °F |
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| Exact Mass | 111.12500 |
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| PSA | 37.30000 |
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| LogP | 1.26120 |
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| Vapour Pressure | 31.8mmHg at 25°C |
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| Index of Refraction | n20/D 1.4076(lit.) |
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| InChIKey | NQPDZGIKBAWPEJ-YNSOAAEFSA-N |
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| SMILES | CCCCC(=O)O |
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| Storage condition | 2-8°C |
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Safety Information
| Symbol |
GHS05, GHS07 |
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| Signal Word | Danger |
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| Hazard Statements | H302-H314 |
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| Precautionary Statements | P280-P305 + P351 + P338-P310 |
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| Hazard Codes | C: Corrosive; |
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| Risk Phrases | 34-52/53 |
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| Safety Phrases | 26-36-45-61 |
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| RIDADR | UN 3265 8/PG 3 |
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Synonyms
| perdeuterated pentanoic acid |
| Isopropyl-d7-benzene |
| <2H6>-Diethylketon |
| <2H9>valeric acid |
| MFCD00145082 |
| Cumene-isopropyl-d7 |
| Pentan-3-on-1,1,1,5,5,5-d6 |
| 3-Pentanon-1.1.1-5.5.5-d6 |
| isopropylbenzene-d7 |
| 1,1,1,5,5,5-hexadeuterio-pentan-3-one |
| <2H6>cumene |
