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| CAS No.: | 51146-56-6 |
|---|---|
| Name: | (S)-(+)-Ibuprofen |
| Article Data: | 157 |
| Molecular Structure: | |
|
|
|
| Formula: | C13H18O2 |
| Molecular Weight: | 206.285 |
| Synonyms: | Benzeneaceticacid, a-methyl-4-(2-methylpropyl)-,(S)-;(+)-(S)-Ibuprofen;(+)-(S)-p-Isobutylhydratropic acid;(+)-Ibuprophen;(+)-a-Methyl-4-(2-methylpropyl)benzeneacetic acid;(S)-(+)-2-(4-Isobutylphenyl)propionic acid;(S)-(+)-p-Isobutylhydratropic acid;(S)-2-(4-Isobutylphenyl)propanoicacid;(aS)-a-Methyl-4-(2-methylpropyl)benzeneaceticacid;Nyfen;S-Optifen;Seractil;Ultraprofen;Benzeneacetic acid, a-methyl-4-(2-methylpropyl)-, (aS)-; |
| EINECS: | 610-620-9 |
| Density: | 1.029 g/cm3 |
| Melting Point: | 49-53 °C(lit.) |
| Boiling Point: | 319.6 °C at 760 mmHg |
| Flash Point: | 216.7 °C |
| Solubility: | insoluble in water |
| Appearance: | colourless, crystalline solid |
| Hazard Symbols: |
 Xn
|
| Risk Codes: | 63-22 |
| Safety: | 45-36/37 |
| PSA: | 37.30000 |
| LogP: | 3.07320 |
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Chemistry
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IUPAC Name: (2S)-2-[4-(2-Methylpropyl)phenyl]propanoic acid
Molecular Formula: C13H18O2
Molecular Weight: 206.28 g/mol
Canonical SMILES: c1([C@H](C(O)=O)C)ccc(CC(C)C)cc1
InChI: InChI=1/C13H18O2/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15/h4-7,9-10H,8H2,1-3H3,(H,14,15)/t10-/m0/s1
Classification Code: Analgesic; Anti-inflammatory
Product Categories: Chiral Reagents; Chiral Compound; Inhibitors; Intermediates & Fine Chemicals; Pharmaceuticals
Stability: Stable. Incompatible with strong oxidizing agents.
Solubility: 45% (w/v) aq 2-hydroxypropyl-β-cyclodextrin: 1.5 mg/mL
Water Solubility: insoluble
Density: 1.029 g/cm3
Flash Point: 216.7 °C
Enthalpy of Vaporization: 59.25 kJ/mol
Boiling Point: 319.6 °C at 760 mmHg
Melting Point: 49-53 °C(lit.)
alpha: 57 °(c=2, EtOH)
Vapour Pressure of Dexibuprofen (CAS NO.51146-56-6): 0.000139 mmHg at 25 °C
Uses
Dexibuprofen (CAS NO.51146-56-6) is used as a nonsteroidal anti-inflammatory drug (NSAID).
Safety Profile
Hazard Codes: 
Xn
Risk Statements: 63-22
R22: Harmful if swallowed.
R63: Possible risk of harm to the unborn child.
Safety Statements: 45-36/37
S45: In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)
S36/37: Wear suitable protective clothing and gloves.
WGK Germany of Dexibuprofen (CAS NO.51146-56-6): 3
Specification
Dexibuprofen (CAS NO.51146-56-6), its Synonyms are Dexibuprofene ; (+)-(S)-p-Isobutylhydratropic acid ; Benzeneacetic acid, alpha-methyl-4-(2-methylpropyl)-, (S)- ; Dexibuprofeno [INN-Spanish] ; Dexibuprofenum ; (S)-(+)-Ibuprofen . It is colourless, crystalline solid.