ethyl 2-(5-bromothiophen-2-yl)-2-oxoacetate


Chemical Name: ethyl 2-(5-bromothiophen-2-yl)-2-oxoacetate
CAS Number: 22098-10-8
Product Number: AG00709K(AGN-PC-0KK7S2)
Synonyms:
MDL No:
Molecular Formula: C8H7BrO3S
Molecular Weight: 263.1084

Identification/Properties


Computed Properties
Molecular Weight:
263.105g/mol
XLogP3:
2.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
4
Exact Mass:
261.93g/mol
Monoisotopic Mass:
261.93g/mol
Topological Polar Surface Area:
71.6A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
219
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:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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