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Haloperidol Decanoate EP Impurity J

CAT: 1299-RM-H121629-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-H121629-01Size:10 mg
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CAS Number
1797983-18-6
Synonyms
4- (4-chlorophenyl) -1- (4- (4-fluorophenyl) -4-oxobutyl) piperidin-4-yl undecanoate
Molecular Formula
C32H43ClFNO3
Molecular Weight
544.14
Target Alternative Name
Haloperidol
Product Name Synonym
4- (4-chlorophenyl) -1- (4- (4-fluorophenyl) -4-oxobutyl) piperidin-4-yl undecanoate

Chemical Information

Haloperidol Undecanoate
CAS Number1797983-18-6
PubChem CID76957705
IUPAC Name[4-(4-chlorophenyl)-1-[4-(4-fluorophenyl)-4-oxobutyl]piperidin-4-yl] undecanoate
Molecular FormulaC32H43ClFNO3
Molecular Weight544.1
XLogP8.4
Topological Polar Surface Area46.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count17
Heavy Atom Count38
Formal Charge0
Complexity680
SMILES
CCCCCCCCCCC(=O)OC1(CCN(CC1)CCCC(=O)C2=CC=C(C=C2)F)C3=CC=C(C=C3)Cl
InChI
InChI=1S/C32H43ClFNO3/c1-2-3-4-5-6-7-8-9-12-31(37)38-32(27-15-17-28(33)18-16-27)21-24-35(25-22-32)23-10-11-30(36)26-13-19-29(34)20-14-26/h13-20H,2-12,21-25H2,1H3
InChIKey
SILFUYMQHCIFAV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Haloperidol Undecanoate
CAS: 1797983-18-6
CID: 76957705
Formula: C32H43ClFNO3
MW: 544.1
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight544.1
XLogP38.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count17
Exact Mass543.2915501
Monoisotopic Mass543.2915501
Topological Polar Surface Area46.6 Ų
Heavy Atom Count38
Formal Charge0
Complexity680
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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RM-H121626-01Haloperidol Decanoate EP Impurity H
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RM-H121620-01Haloperidol Decanoate EP Impurity B

Alternative Products

CatalogName
AR-H07311-01Haloperidol Decanoate EP Impurity A
AR-H07314-01Haloperidol Decanoate EP Impurity L
AR-H07313-01Haloperidol Decanoate EP Impurity C
AR-H01046-01Haloperidol Decanoate EP Impurity E
AR-H01054-01Haloperidol Decanoate EP Impurity J
AR-H01047-01Haloperidol Decanoate EP Impurity D
AR-H01052-01Haloperidol Decanoate EP Impurity H
AR-H01050-01Haloperidol Decanoate EP Impurity A HCl
AR-H01053-01Haloperidol Decanoate EP Impurity I
AR-H07312-01Haloperidol Decanoate EP Impurity B

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