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Pitavastatin impurity 1 (Standard)

CAT: 0804-HY-Z3150RSize: 1 EachDry Ice: NoHazardous: No
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Description
3- (bromomethyl) -2-cyclopropyl-4- (4-fluorophenyl) quinoline (Pitavastatin Impurity) (Standard) is the analytical standard of 3- (bromomethyl) -2-cyclopropyl-4- (4-fluorophenyl) quinoline (Pitavastatin Impurity) . This product is intended for research and analytical applications.
CAS Number
154057-56-4
UNSPSC
12352005
Hazard Statement
H302, H314
Target
Reference Standards
Related Pathways
Others
Smiles
FC1=CC=C(C2=C(CBr)C(C3CC3)=NC4=CC=CC=C24)C=C1
Molecular Formula
C19H15BrFN
Molecular Weight
356.23
Precautions
H302, H314
Shipping Conditions
Room temperature
Scientific Category
Reference Standards

Chemical Information

3-(Bromomethyl)-2-cyclopropyl-4-(4-fluorophenyl)quinoline
CAS Number154057-56-4
PubChem CID29927785
IUPAC Name3-(bromomethyl)-2-cyclopropyl-4-(4-fluorophenyl)quinoline
Molecular FormulaC19H15BrFN
Molecular Weight356.2
XLogP5.1
Topological Polar Surface Area12.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count22
Formal Charge0
Complexity378
SMILES
C1CC1C2=NC3=CC=CC=C3C(=C2CBr)C4=CC=C(C=C4)F
InChI
InChI=1S/C19H15BrFN/c20-11-16-18(12-7-9-14(21)10-8-12)15-3-1-2-4-17(15)22-19(16)13-5-6-13/h1-4,7-10,13H,5-6,11H2
InChIKey
QCNHMJKMLPPGMF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-(Bromomethyl)-2-cyclopropyl-4-(4-fluorophenyl)quinoline
CAS: 154057-56-4
CID: 29927785
Formula: C19H15BrFN
MW: 356.2
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight356.2
XLogP35.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass355.03719
Monoisotopic Mass355.03719
Topological Polar Surface Area12.9 Ų
Heavy Atom Count22
Formal Charge0
Complexity378
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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