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Haloperidol Decanoate EP Impurity H

CAT: 1299-RM-H121626-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-H121626-01Size:10 mg
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CAS Number
1134807-34-3
Synonyms
4- (4-chlorophenyl) -1- (4- (4-fluorophenyl) -4-oxobutyl) piperidin-4-yl octanoate
Molecular Formula
C29H37ClFNO3
Molecular Weight
502.06
Target Alternative Name
Haloperidol
Product Name Synonym
4- (4-chlorophenyl) -1- (4- (4-fluorophenyl) -4-oxobutyl) piperidin-4-yl octanoate

Chemical Information

Haloperidol octanoate
CAS Number1134807-34-3
PubChem CID71587934
IUPAC Name[4-(4-chlorophenyl)-1-[4-(4-fluorophenyl)-4-oxobutyl]piperidin-4-yl] octanoate
Molecular FormulaC29H37ClFNO3
Molecular Weight502.1
XLogP6.8
Topological Polar Surface Area46.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count14
Heavy Atom Count35
Formal Charge0
Complexity636
SMILES
CCCCCCCC(=O)OC1(CCN(CC1)CCCC(=O)C2=CC=C(C=C2)F)C3=CC=C(C=C3)Cl
InChI
InChI=1S/C29H37ClFNO3/c1-2-3-4-5-6-9-28(34)35-29(24-12-14-25(30)15-13-24)18-21-32(22-19-29)20-7-8-27(33)23-10-16-26(31)17-11-23/h10-17H,2-9,18-22H2,1H3
InChIKey
SWELMJJZDVTJRJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Haloperidol octanoate
CAS: 1134807-34-3
CID: 71587934
Formula: C29H37ClFNO3
MW: 502.1
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight502.1
XLogP36.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count14
Exact Mass501.2445999
Monoisotopic Mass501.2445999
Topological Polar Surface Area46.6 Ų
Heavy Atom Count35
Formal Charge0
Complexity636
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-H121629-01Haloperidol Decanoate EP Impurity J
RM-H121630-01Haloperidol Decanoate EP Impurity K
RM-H121623-01Haloperidol Decanoate EP Impurity E
RM-H121622-01Haloperidol Decanoate EP Impurity D
RM-H121621-01Haloperidol Decanoate EP Impurity C
RM-H121624-01Haloperidol Decanoate EP Impurity F
RM-H121628-01Haloperidol Decanoate EP Impurity I
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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