5-Ethoxycarbonyl-2-thienylzinc bromide solution
Product Information
Molecular Formula
C7H7BrO2SZn
Molecular Weight
300.49
Description
5-Ethoxycarbonyl-2-thienylzinc bromide solution is an indispensable reagent employed in the biomedical sector, exemplifies its pivotal role as a precursor for synthesizing a myriad of pharmaceuticals, unparalleled in their efficacy against afflictions such as cancer, infectious maladies, and neurological ailments.
Synonyms
5-ETHOXYCARBONYL-2-THIENYLZINC BROMIDE; 5-Ethoxycarbonyl-2-thienylzinc bromide 0.5 M in Tetrahydrofuran; Bromozinc(1+); ethyl 2H-thiophen-2-ide-5-carboxylate; 5-Ethoxycarbonyl-2-thienylzinc bromide, 0.5M in tetrahydrofuran
IUPAC Name
bromozinc(1+)ethyl 2H-thiophen-2-ide-5-carboxylate
SMILES
CCOC(=O)C1=CC=[C-]S1.[Zn+]Br
InChI
InChI=1S/C7H7O2S.BrH.Zn/c1-2-9-7(8)6-4-3-5-10-6/h3-4H,2H2,1H31H/q-1+2/p-1
InChI Key
YFPILNMHJDQSAK-UHFFFAOYSA-M
Flash Point
1.4 °F
Density
0.994 g/mL at 25 °C
Storage
2-8°C
Safety Information
Hazards
H225-H302-H319-H335-H351
Precautionary Statement
P210-P280-P301 + P312 + P330-P305 + P351 + P338-P370 + P378-P403 + P235
Computed Properties
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
3
Exact Mass
297.86415 g/mol
Monoisotopic Mass
297.86415 g/mol
Topological Polar Surface Area
51.6Ų
Heavy Atom Count
12
Formal Charge
0
Complexity
204
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
2
Compound Is Canonicalized
Yes
