Miconazole EP Impurity G

CAT: 1596-AR-M02812-01Size: 25 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-M02812-01Size:25 Units

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CAS Number

909277-71-0

Synonyms

2,5-Dichloro Miconazole; 1-[2- (2,4-Dichlorophenyl) -2-[ (2,5-dichlorophenyl) methoxy]ethyl]-1H-imidazole

Molecular Formula

C18H14Cl4N2O

Molecular Weight

416.12

API Name

Miconazole

Chemical Information

K23Zyc9scb

CAS Number	909277-71-0
PubChem CID	60209606
IUPAC Name	1-[2-(2,4-dichlorophenyl)-2-[(2,5-dichlorophenyl)methoxy]ethyl]imidazole
Molecular Formula	C18H14Cl4N2O
Molecular Weight	416.1
XLogP	5.3
Topological Polar Surface Area	27.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	6
Heavy Atom Count	25
Formal Charge	0
Complexity	417

SMILES

C1=CC(=C(C=C1Cl)Cl)C(CN2C=CN=C2)OCC3=C(C=CC(=C3)Cl)Cl

InChI

InChI=1S/C18H14Cl4N2O/c19-13-2-4-16(21)12(7-13)10-25-18(9-24-6-5-23-11-24)15-3-1-14(20)8-17(15)22/h1-8,11,18H,9-10H2

InChIKey

UXZDCVPAHZEYLF-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 909277-71-0

CID: 60209606

Formula: C18H14Cl4N2O

MW: 416.1

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	416.1
XLogP3	5.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	6
Exact Mass	415.983074
Monoisotopic Mass	413.986024
Topological Polar Surface Area	27.1 Å²
Heavy Atom Count	25
Formal Charge	0
Complexity	417
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
AR-M02688-01	Miconazole EP Impurity I
AR-M02687-01	Miconazole EP Impurity H
AR-M01775-01	Miconazole EP Impurity B
AR-M02686-01	Miconazole EP Impurity E
AR-M03142-01	Miconazole EP Impurity C
AR-M01774-01	Miconazole EP Impurity F
AR-M02817-01	Miconazole EP Impurity I Nitrate
AR-M04636-01	Miconazole EP Impurity I HCl
AR-M04630-01	Miconazole EP Impurity E Bromide
AR-M01779-01	Miconazole EP Impurity I HCl

Catalog	Name
RM-M090301-01	Miconazole Impurity A
TRC-M342495-1G	Miconazole Impurity I
RM-M031401-01	Miconazole Nitrate Impurity A
164978	Miconazole Impurity B
RM-M031410-01	Miconazole Impurity 10
TRC-M342490-25MG	Miconazole Impurity H
164980	Miconazole Impurity H-d7
RM-M031418-01	Miconazole Nitrate Impurity 18
RM-M031414-01	Miconazole Nitrate Impurity 14
RM-M031412-01	Miconazole Nitrate Impurity 12