Luliconazole Impurity 15

CAT: 1299-RM-L120315-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-L120315-01Size:10 mg

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CAS Number

141394-11-8

Synonyms

(S) -2- (2,4-dichlorophenyl) oxirane

Molecular Formula

C8H6Cl2O

Molecular Weight

189.04

Target Alternative Name

Luliconazole

Product Name Synonym

(S) -2- (2,4-dichlorophenyl) oxirane

Chemical Information

(2S)-2-(2,4-dichlorophenyl)oxirane

CAS Number	141394-11-8
PubChem CID	40582612
IUPAC Name	(2S)-2-(2,4-dichlorophenyl)oxirane
Molecular Formula	C8H6Cl2O
Molecular Weight	189.04
XLogP	2.6
Topological Polar Surface Area	12.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Heavy Atom Count	11
Formal Charge	0
Complexity	151

SMILES

C1[C@@H](O1)C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C8H6Cl2O/c9-5-1-2-6(7(10)3-5)8-4-11-8/h1-3,8H,4H2/t8-/m1/s1

InChIKey

ZRMLHFOKDLDAIB-MRVPVSSYSA-N

Chemical Structure

2D Structure

CAS: 141394-11-8

CID: 40582612

Formula: C8H6Cl2O

MW: 189.04

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	189.04
XLogP3	2.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	187.9795702
Monoisotopic Mass	187.9795702
Topological Polar Surface Area	12.5 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	151
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
AR-L08141-01	Luliconazole Fragment Impurity
AR-L08142-01	Luliconazole Methanesulfonate Impurity
L064-5G	Luliconazole
GTR19223342-01	Luliconazole, (+) -
MBS5782507	Luliconazole, (+)-