| Identification | Back Directory | [Name]
tert-butyl(4-(3-(dimethoxyphosphoryl)-2-oxopropyl)phenyl)carbamate | [CAS]
494224-44-1 | [Synonyms]
tert-butyl(4-(3-(dimethoxyphosphoryl)-2-oxopropyl)phenyl)carbamate
Carbamic acid, N-[4-[3-(dimethoxyphosphinyl)-2-oxopropyl]phenyl]-, 1,1-dimethylethyl ester | [Molecular Formula]
C16H24NO6P | [MDL Number]
MFCD30803442 | [MOL File]
494224-44-1.mol | [Molecular Weight]
357.34 |
| Chemical Properties | Back Directory | [Boiling point ]
436.7±35.0 °C(Predicted) | [density ]
1.212±0.06 g/cm3(Predicted) | [storage temp. ]
Storage temp. 2-8°C | [pka]
13.60±0.70(Predicted) | [Appearance]
Light yellow to yellow Solid | [InChI]
InChI=1S/C16H24NO6P/c1-16(2,3)23-15(19)17-13-8-6-12(7-9-13)10-14(18)11-24(20,21-4)22-5/h6-9H,10-11H2,1-5H3,(H,17,19) | [InChIKey]
ZALILTZJEZWNEH-UHFFFAOYSA-N | [SMILES]
C(OC(C)(C)C)(=O)NC1=CC=C(CC(=O)CP(OC)(OC)=O)C=C1 |
| Hazard Information | Back Directory | [Uses]
[3-(4-tert-Butoxycarbonylamino-phenyl)-2-oxo-propyl]-phosphonic Acid Dimethyl Ester can be used as reactant/reagent in process for preparation of beta-3 agonists with key step of amidation of dibenzylpyrrolidine intermediate. | [Pharmaceutical Applications]
In medical chemistry, tert-butyl(4-(3-(dimethoxyphosphoryl)-2-oxopropyl)phenyl)carbamate can be involved in synthesis of Vibegron, a prescription oral tablet used to treat adult overactive bladder (OAB) symptoms. |
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