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p-Fluoro Fentanyl-d3

CAT: 0572-TRC-F588482-10MGSize: 10 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-F588482-10MGSize:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1189887-65-7
Synonyms
N-(4-Fluorophenyl)-N-[1-(2-phenylethyl)-4-piperidinyl]propanamide-d3;
Hazard Statement
Fatal in contact with skin; UN number: UN2811; Packing Group: II
Smiles
[2H]C([2H])([2H])CC(=O)N(C1CCN(CCc2ccccc2)CC1)c3ccc(F)cc3
Molecular Formula
C22H24D3FN2O
Molecular Weight
357.48
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

p-Fluoro Fentanyl-d3
CAS Number1189887-65-7
PubChem CID46781607
IUPAC Name3,3,3-trideuterio-N-(4-fluorophenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide
Molecular FormulaC22H27FN2O
Molecular Weight357.5
XLogP4.2
Topological Polar Surface Area23.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Heavy Atom Count26
Formal Charge0
Complexity422
SMILES
[2H]C([2H])([2H])CC(=O)N(C1CCN(CC1)CCC2=CC=CC=C2)C3=CC=C(C=C3)F
InChI
InChI=1S/C22H27FN2O/c1-2-22(26)25(20-10-8-19(23)9-11-20)21-13-16-24(17-14-21)15-12-18-6-4-3-5-7-18/h3-11,21H,2,12-17H2,1H3/i1D3
InChIKey
KXUBAVLIJFTASZ-FIBGUPNXSA-N
Chemical Structure
2D Structure
2D structure of p-Fluoro Fentanyl-d3
CAS: 1189887-65-7
CID: 46781607
Formula: C22H27FN2O
MW: 357.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight357.5
XLogP34.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Exact Mass357.22957189
Monoisotopic Mass357.22957189
Topological Polar Surface Area23.6 Ų
Heavy Atom Count26
Formal Charge0
Complexity422
Isotope Atom Count3
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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Alternative Products

CatalogName
CS-TB-52809P-Fluoro Fentanyl-d3
CS-T-94522P-​FLUORO FENTANYL
CS-T-52299Despropionyl p-Fluoro Fentanyl
276283-01P-Fluoro fentanyl discontinued
271761-01Despropionyl p-fluoro fentanyl discontinued
MBS6110174-01Fentanyl(p) (HRP)
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461840-01P-Fluorobutyryl Fentanyl Hydrochloride discontinued
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