3-(ETHOXYCARBONYL)PHENYLZINC IODIDE

Product Information

Molecular Formula:
C9H9IO2Zn
Molecular Weight:
341.46
Description
3-(Ethoxycarbonyl)phenylzinc iodide is a highly versatile pharmaceutical intermediary extensively employed in the biomedicine industry. Renowned for its potency and remarkable efficacy, it finds immense utility in combatting multifarious maladies such as cancer, cardiovascular disorders, and neurological conditions. Through its distinctive molecular architecture, it engages in precise interactions with specific molecular entities, thereby facilitating the fabrication of innovative therapeutics exhibiting unparalleled effectiveness and utmost selectivity.
Synonyms
3-(ETHOXYCARBONYL)PHENYLZINC IODIDE; 3-(ETHOXYCARBONYL)PHENYLZINC IODIDE, 0.5 M SOLUTION IN TETRAHYDROFURAN; 3-(ethoxycarbonyl)phenylzinc iodide solution
IUPAC Name
ethyl benzoateiodozinc(1+)
Canonical SMILES
CCOC(=O)C1=C[C-]=CC=C1.[Zn+]I
InChI
InChI=1S/C9H9O2.HI.Zn/c1-2-11-9(10)8-6-4-3-5-7-8;;/h3-4,6-7H,2H2,1H3;1H;/q-1;;+2/p-1
InChI Key
KNTSJWIWLNBYJL-UHFFFAOYSA-M
Flash Point
1.0 °F - closed cup
Purity
95%
Density
0.991
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
3
Rotatable Bond Count
3
Exact Mass
339.89387 g/mol
Monoisotopic Mass
339.89387 g/mol
Topological Polar Surface Area
26.3Ų
Heavy Atom Count
13
Formal Charge
0
Complexity
244
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
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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