| Identification | Back Directory | [Name]
INDEX NAME NOT YET ASSIGNED | [CAS]
2649788-75-8 | [Synonyms]
tert-Butyl (4-bromo-3-cyanobenzo[b]thiophen-2-yl)carbamate
tert-butyl N-(4-bromo-3-cyano-benzothiophen-2-yl)carbamate | [Molecular Formula]
C14H13BrN2O2S | [MOL File]
2649788-75-8.mol | [Molecular Weight]
353.23 |
| Chemical Properties | Back Directory | [Boiling point ]
441.7±45.0 °C(Predicted) | [density ]
1.53±0.1 g/cm3(Predicted) | [pka]
11.28±0.43(Predicted) | [InChI]
InChI=1S/C14H13BrN2O2S/c1-14(2,3)19-13(18)17-12-8(7-16)11-9(15)5-4-6-10(11)20-12/h4-6H,1-3H3,(H,17,18) | [InChIKey]
NUKJBVCAKRBXQA-UHFFFAOYSA-N | [SMILES]
C(C1=C(SC2=CC=CC(Br)=C12)NC(=O)OC(C)(C)C)#N |
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