Thiophene, 2-bromo-5-(ethynyl)-


Chemical Name: Thiophene, 2-bromo-5-(ethynyl)-
CAS Number: 105995-73-1
Product Number: AG0084MV(AGN-PC-0NI107)
Synonyms:
MDL No: MFCD08703509
Molecular Formula: C6H3BrS
Molecular Weight: 187.0570

Identification/Properties


Computed Properties
Molecular Weight:
187.054g/mol
XLogP3:
2.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
1
Exact Mass:
185.914g/mol
Monoisotopic Mass:
185.914g/mol
Topological Polar Surface Area:
28.2A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
124
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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