1-(5-bromo-4-methylthiophen-2-yl)ethanone


Chemical Name: 1-(5-bromo-4-methylthiophen-2-yl)ethanone
CAS Number: 859199-06-7
Product Number: AG004WLR(AGN-PC-07CN7P)
Synonyms:
MDL No:
Molecular Formula: C7H7BrOS
Molecular Weight: 219.0989

Identification/Properties


Properties
MP:
63-67℃
BP:
299°C at 760 mmHg
Storage:
Keep in dry area;-10 ℃;
Form:
Solid
Computed Properties
Molecular Weight:
219.096g/mol
XLogP3:
3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
217.94g/mol
Monoisotopic Mass:
217.94g/mol
Topological Polar Surface Area:
45.3A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
149
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#:
-
Hazard Statements:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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