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CAS Number: 141524-73-4
(4-bromo-1-methyl-1H-imidazol-5-yl)methanol

Structure

(4-bromo-1-methyl-1H-imidazol-5-yl)methanol
Name: (4-bromo-1-methyl-1H-imidazol-5-yl)methanol
Synonyms:
General Information
Product Number: 141524734
CAS Registry Number: 141524-73-4
Name:
        1H-​Imidazole-​5-​methanol, 4-​bromo-​1-​methyl-
 
Chemical Formula: C5H7BrN2O
Exact Mass: 189.97
Molecular Weight: 191.03
m/z: 189.97 (100.0%), 191.97 (97.3%), 190.98 (5.5%), 192.98 (5.4%)
Elemental Analysis: C, 31.44; H, 3.69; Br, 41.83; N, 14.66; O, 8.38
 
InChI: InChI=1S/C12H14N2O3S/c1-12(2)3-8(15)7(9(16)4-12)6-14-10(17)5-13-11(14)18/h6H,3-5H2,1-2H3,(H,13,18)
InChIKey: LTIRCGUYBIWMNI-UHFFFAOYSA-N
Canonical SMILES : CC1(CC(=O)C(=CN2C(=O)CNC2=S)C(=O)C1)C

Specification

98%

References

PCT Int. Appl. (2013), WO 2013025733 A1 20130221.

Science of Synthesis (2002), 12, 325-528.                                 

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