(2-CHLORO-5-PYRIDYL)METHYLZINC CHLORIDE
Product Information
Molecular Formula
C6H5Cl2NZn
Molecular Weight
227.41
Description
2-Chloro-5-pyridyl)methylzinc Chloride, a pivotal component instrumental for organic synthesis, plays a crucial role in the pharmaceutical domain. Its heightened reactivity drives drug discovery for cardiovascular disease and specific carcinogenic entities.
Synonyms
(6-CHLORO-3-PYRIDYL)METHYLZINC CHLORIDE; (2-CHLORO-5-PYRIDYL)METHYLZINC CHLORIDE; (2-CHLORO-5-PYRIDYL)METHYLZINC CHLORIDE, 0.5M SOLUTION IN TETRAHYDROFURAN; (2-chloro-5-pyridyl)methylzinc chloride solution
IUPAC Name
2-chloro-5-methanidylpyridinechlorozinc(1+)
SMILES
[CH2-]C1=CN=C(C=C1)Cl.Cl[Zn+]
InChI
InChI=1S/C6H5ClN.ClH.Zn/c1-5-2-3-6(7)8-4-5/h2-4H,1H21H/q-1+2/p-1
InChI Key
PQSXTBMHLNJQKD-UHFFFAOYSA-M
Boiling Point
65 °C
Flash Point
1.0 °F - closed cup
Density
0.992
Appearance
Brown to black liquid
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
2
Rotatable Bond Count
0
Exact Mass
224.909046 g/mol
Monoisotopic Mass
224.909046 g/mol
Topological Polar Surface Area
12.9Ų
Heavy Atom Count
10
Formal Charge
0
Complexity
82.1
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
