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Ciprofibrate EP Impurity E

CAT: 1299-RM-C091605-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-C091605-01Size:10 mg
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CAS Number
52179-28-9
Synonyms
Ethyl 2- (4- (2,2-dichlorocyclopropyl) phenoxy) -2-methylpropanoate
Molecular Formula
C15H18Cl2O3
Molecular Weight
317.21
Target Alternative Name
Ciprofibrate
Product Name Synonym
Ethyl 2- (4- (2,2-dichlorocyclopropyl) phenoxy) -2-methylpropanoate

Chemical Information

Ethyl 2-[4-(2,2-dichlorocyclopropyl)phenoxy]-2-methylpropionate
CAS Number52179-28-9
PubChem CID103600
IUPAC Nameethyl 2-[4-(2,2-dichlorocyclopropyl)phenoxy]-2-methylpropanoate
Molecular FormulaC15H18Cl2O3
Molecular Weight317.2
XLogP4.1
Topological Polar Surface Area35.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Heavy Atom Count20
Formal Charge0
Complexity360
SMILES
CCOC(=O)C(C)(C)OC1=CC=C(C=C1)C2CC2(Cl)Cl
InChI
InChI=1S/C15H18Cl2O3/c1-4-19-13(18)14(2,3)20-11-7-5-10(6-8-11)12-9-15(12,16)17/h5-8,12H,4,9H2,1-3H3
InChIKey
UHYJTDLWNOQAFE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ethyl 2-[4-(2,2-dichlorocyclopropyl)phenoxy]-2-methylpropionate
CAS: 52179-28-9
CID: 103600
Formula: C15H18Cl2O3
MW: 317.2
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight317.2
XLogP34.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Exact Mass316.0632998
Monoisotopic Mass316.0632998
Topological Polar Surface Area35.5 Ų
Heavy Atom Count20
Formal Charge0
Complexity360
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