3,5-DIMETHOXYBENZYLZINC CHLORIDE
Product Information
Molecular Formula
C9H11ClO2Zn
Molecular Weight
252.03
Description
3,5-Dimethoxybenzylzinc chloride is a crucial reagent used in the biomedicine industry. It effectively aids in the synthesis of various pharmaceutical drugs targeting diseases such as cancer, diabetes, and neurological disorders by facilitating crucial chemical reactions.
Synonyms
3,5-DIMETHOXYBENZYLZINC CHLORIDE; 3,5-DIMETHOXYBENZYLZINC CHLORIDE, 0.5M SOLUTION IN TETRAHYDROFURAN 3,5-DIMETHOXYBENZYLZINC CHLORIDE, 0.5M SOLUTION IN T; 3,5-dimethoxybenzylzinc chloride solution
IUPAC Name
chlorozinc(1+)1-methanidyl-3,5-dimethoxybenzene
SMILES
COC1=CC(=CC(=C1)[CH2-])OC.Cl[Zn+]
InChI
InChI=1S/C9H11O2.ClH.Zn/c1-7-4-8(10-2)6-9(5-7)11-3/h4-6H,1H2,2-3H31H/q-1+2/p-1
InChI Key
PDLKBNJDKMOTDI-UHFFFAOYSA-M
Boiling Point
65 °C
Flash Point
1.4 °F - closed cup
Density
0.966
Appearance
Brown liquid
Storage
2-8°C
Safety Information
Hazards
H225 - H261 - H302 - H319 - H335 - H336 - H351
Precautionary Statement
P201 - P210 - P231 + P232 - P301 + P312 - P305 + P351 + P338 - P308 + P313
Computed Properties
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
2
Exact Mass
249.973899 g/mol
Monoisotopic Mass
249.973899 g/mol
Topological Polar Surface Area
18.5Ų
Heavy Atom Count
13
Formal Charge
0
Complexity
112
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
