2-Thiopheneacetonitrile, 5-bromo-


Chemical Name: 2-Thiopheneacetonitrile, 5-bromo-
CAS Number: 71637-37-1
Product Number: AG005G90(AGN-PC-0JWIUI)
Synonyms:
MDL No:
Molecular Formula: C6H4BrNS
Molecular Weight: 202.0717

Identification/Properties


Properties
BP:
285.2°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
202.069g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
200.925g/mol
Monoisotopic Mass:
200.925g/mol
Topological Polar Surface Area:
52A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
139
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

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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