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Dapaconazole

CAT: 1596-AR-D01122-02Size: 25 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-D01122-02Size:25 Units
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CAS Number
1269726-67-1
Synonyms
1- (2- (2,4-dichlorophenyl) -2- ((4- (trifluoromethyl) benzyl) oxy) ethyl) -1H-imidazole; 1- (Rac-2- (2,4-dichlorophenyl) -2- ((4- (trifluoromethyl) phenyl) methoxy) ethyl) -1H-imidazole;1H-Imidazole, 1- (2- (2,4-dichlorophenyl) -2- ((4- (trifluoromethyl) phenyl) methoxy) ethyl) -
Molecular Formula
C19H15Cl2F3N2O
Molecular Weight
415.24
API Name
Dapaconazole

Chemical Information

Dapaconazole

Dapaconazole has been used in trials studying the treatment of Tinea Pedis.

CAS Number1269726-67-1
PubChem CID51001696
IUPAC Name1-[2-(2,4-dichlorophenyl)-2-[[4-(trifluoromethyl)phenyl]methoxy]ethyl]imidazole
Molecular FormulaC19H15Cl2F3N2O
Molecular Weight415.2
XLogP5.6
Topological Polar Surface Area27.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Heavy Atom Count27
Formal Charge0
Complexity461
SMILES
C1=CC(=CC=C1COC(CN2C=CN=C2)C3=C(C=C(C=C3)Cl)Cl)C(F)(F)F
InChI
InChI=1S/C19H15Cl2F3N2O/c20-15-5-6-16(17(21)9-15)18(10-26-8-7-25-12-26)27-11-13-1-3-14(4-2-13)19(22,23)24/h1-9,12,18H,10-11H2
InChIKey
FUAHXHWSMYFWGE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Dapaconazole
CAS: 1269726-67-1
CID: 51001696
Formula: C19H15Cl2F3N2O
MW: 415.2
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight415.2
XLogP35.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass414.0513530
Monoisotopic Mass414.0513530
Topological Polar Surface Area27.1 Ų
Heavy Atom Count27
Formal Charge0
Complexity461
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
HY-16719-01Dapaconazole

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