3-Thiophenecarboxaldehyde, 4-bromo-


Chemical Name: 3-Thiophenecarboxaldehyde, 4-bromo-
CAS Number: 18791-78-1
Product Number: AG002GKU(AGN-PC-0KKQ2S)
Synonyms:
MDL No:
Molecular Formula: C5H3BrOS
Molecular Weight: 191.0457

Identification/Properties


Properties
BP:
237.9°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Refractive Index:
1.6310 to 1.6350
Computed Properties
Molecular Weight:
191.042g/mol
XLogP3:
1.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
189.909g/mol
Monoisotopic Mass:
189.909g/mol
Topological Polar Surface Area:
45.3A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
96.4
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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