| Identification | Back Directory | [Name]
2-Thiazolepropanoic acid, 4-bromo-α-[[(1,1-dimethylethoxy)carbonyl]amino]-, methyl ester, (αS)- | [CAS]
2641451-73-0 | [Synonyms]
Methyl (S)-2-(Boc-amino)-3-(4-bromo-2-thiazolyl)propanoate
methyl (S)-3-(4-bromothiazol-2-yl)-2-((tert-butoxycarbonyl)amino)propanoate
methyl (2S)-3-(4-bromo-1,3-thiazol-2-yl)-2-{[(tert-butoxy)carbonyl]amino}propanoate
2-Thiazolepropanoic acid, 4-bromo-α-[[(1,1-dimethylethoxy)carbonyl]amino]-, methyl ester, (αS)- | [Molecular Formula]
C12H17BrN2O4S | [MDL Number]
MFCD34179557 | [MOL File]
2641451-73-0.mol | [Molecular Weight]
365.24 |
| Chemical Properties | Back Directory | [Boiling point ]
459.9±45.0 °C(Predicted) | [density ]
1.444±0.06 g/cm3(Predicted) | [storage temp. ]
2-8°C, stored under nitrogen | [pka]
10.57±0.46(Predicted) | [Appearance]
White to off-white Solid | [Optical Rotation]
37°(C=0.01 g/ml, CHCL3, 20°C, 589nm) | [InChI]
InChI=1/C12H17BrN2O4S/c1-12(2,3)19-11(17)14-7(10(16)18-4)5-9-15-8(13)6-20-9/h6-7H,5H2,1-4H3,(H,14,17)/t7-/s3 | [InChIKey]
XOHKCICGHIWNNO-KPOCXSGKNA-N | [SMILES]
C(C1SC=C(Br)N=1)[C@@H](C(=O)OC)NC(=O)OC(C)(C)C |&1:7,r| |
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