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Econazole

CAT: 1568-C11074-02Size: 1 gDry Ice: YesHazardous: No
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CAT#:1568-C11074-02Size:1 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
27220-47-9
SKU
C11074-25mg
Target
Bacterial
Applications
Microbiology
Smiles
C1=CC (=CC=C1COC (CN2C=CN=C2) C3=C (C=C (C=C3) Cl) Cl) Cl
Molecular Formula
C18H15Cl3N2O
Additionnal Information
Econazole is a broad spectrum antimycotic with some action against Gram positive bacteria.
Storage Conditions
2 years -80 in solvent

Chemical Information

Econazole

1-{2-(4-chlorobenzyloxy)-2-(2,4-dichlorophenyl)ethyl}imidazole is a member of the class of imidazoles that is 1-(2,4-dichlorophenyl)-2-(imidazol-1-yl)ethanol in which the hydroxyl hydrogen is replaced by a 4-chlorobenzyl group. It is a dichlorobenzene, a member of imidazoles, an ether and a member of monochlorobenzenes.

CAS Number27220-47-9
PubChem CID3198
IUPAC Name1-[2-[(4-chlorophenyl)methoxy]-2-(2,4-dichlorophenyl)ethyl]imidazole
Molecular FormulaC18H15Cl3N2O
Molecular Weight381.7
XLogP5.3
Topological Polar Surface Area27.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count6
Heavy Atom Count24
Formal Charge0
Complexity379
SMILES
C1=CC(=CC=C1COC(CN2C=CN=C2)C3=C(C=C(C=C3)Cl)Cl)Cl
InChI
InChI=1S/C18H15Cl3N2O/c19-14-3-1-13(2-4-14)11-24-18(10-23-8-7-22-12-23)16-6-5-15(20)9-17(16)21/h1-9,12,18H,10-11H2
InChIKey
LEZWWPYKPKIXLL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Econazole
CAS: 27220-47-9
CID: 3198
Formula: C18H15Cl3N2O
MW: 381.7
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight381.7
XLogP35.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count6
Exact Mass380.024996
Monoisotopic Mass380.024996
Topological Polar Surface Area27.1 Ų
Heavy Atom Count24
Formal Charge0
Complexity379
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
TRC-E326003-2.5GEconazole
317765Econazole Nitrate
HY-B0885R-01Econazole (Standard)
AR-E01022-01Econazole-d4

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