ChemicalBook--->CAS DataBase List--->156339-88-7

156339-88-7

156339-88-7 Structure

156339-88-7 Structure
IdentificationBack Directory
[Name]

Albuterol Aldehyde
[CAS]

156339-88-7
[Synonyms]

Albuterol Aldehyde
Salbutamol EP Imp D
Levalbuterol USP RC D
Salbutamol impurity D CRS
Levalbuterol Related CoMpound D
Salbutamol Impurity D(EP)(hydrochloride)
Albuterol aldehyde benzenesulfonic acid salt
Salbutamol Impurity 4(Salbutamol EP Impurity D)
5-(2-tert-Butylamino-1-hydroxyethyl)-2-hydroxybenzaldehyde
Benzaldehyde, 5-[2-[(1,1-dimethylethyl)amino]-1-hydroxyethyl]-2-hydroxy-
5-[(1RS)-2-[(1,1-diMethylethyl)aMino]-1-hydroxyethyl]-2-hydroxybenzaldehyde
Levalbuterol Related Compound D (30 mg) (5-[2-{(1,1-dimethylethyl)amino}-1-hydroxyethyl]-2-hydroxy-benzaldehyde sulfate)
Salbutamol impurity 4/Salbutamol EP Impurity D/Salbutamol Aldehyde Impurity/5-[2-{(1,1-Dimethylethyl)amino}-1-hydroxyethyl]-2-hydroxy-benzaldehyde
[EINECS(EC#)]

604-604-1
[Molecular Formula]

C13H19NO4
[MDL Number]

MFCD18382150
[MOL File]

156339-88-7.mol
[Molecular Weight]

253.294
Chemical PropertiesBack Directory
[Melting point ]

200-210°C
[Boiling point ]

392.4±42.0 °C(Predicted)
[density ]

1.154±0.06 g/cm3(Predicted)
[storage temp. ]

2-8°C
[solubility ]

DMSO (Slightly, Heated), Water (Slightly), Methanol
[form ]

neat
[pka]

8.02±0.31(Predicted)
[Major Application]

pharmaceutical
[InChI]

InChI=1S/C13H19NO3/c1-13(2,3)14-7-12(17)9-4-5-11(16)10(6-9)8-15/h4-6,8,12,14,16-17H,7H2,1-3H3
[InChIKey]

RNGYKBNYRUYCIV-UHFFFAOYSA-N
[SMILES]

C(=O)C1=CC(C(O)CNC(C)(C)C)=CC=C1O
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P264-P271-P280-P302+P352-P305+P351+P338
[WGK Germany ]

WGK 3
[HS Code ]

2922504500
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Chemical Properties]

Pale Yellow Solid
[Uses]

A related impurity of Albuterol (A514500).
[Synthesis]

1.0g of salbutamol, dissolved in 20ml of N,N-dimethylformamide, then added 10% molar equivalent of tetramethylpiperidine oxide, 10% molar equivalent of tetrabutylammonium chloride, and 20ml of 0.5 mol/L aqueous NaHCO3 solution, after stirring at room t

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