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Omega-Hydroxy Fentanyl-d5

CAT: 0572-TRC-H825302-10MGSize: 10 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-H825302-10MGSize:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1329643-24-4
Synonyms
3-Hydroxy-N-phenyl-N-[1-(2-phenylethyl)-4-piperidinyl]propanamide-d5;
Hazard Statement
Fatal if swallowed; UN number: UN2811; Packing Group: II
Smiles
O=C(CCO)N(C1=C([2H])C([2H])=C([2H])C([2H])=C1[2H])C2CCN(CCC3=CC=CC=C3)CC2
Molecular Formula
C22H23D5N2O2
Molecular Weight
357.5
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

omega-Hydroxy Fentanyl-d5 (1.0mg/ml in Acetonitrile)
CAS Number1329643-24-4
PubChem CID71748859
IUPAC Name3-hydroxy-N-(2,3,4,5,6-pentadeuteriophenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide
Molecular FormulaC22H28N2O2
Molecular Weight357.5
XLogP2.8
Topological Polar Surface Area43.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count7
Heavy Atom Count26
Formal Charge0
Complexity408
SMILES
[2H]C1=C(C(=C(C(=C1[2H])[2H])N(C2CCN(CC2)CCC3=CC=CC=C3)C(=O)CCO)[2H])[2H]
InChI
InChI=1S/C22H28N2O2/c25-18-14-22(26)24(20-9-5-2-6-10-20)21-12-16-23(17-13-21)15-11-19-7-3-1-4-8-19/h1-10,21,25H,11-18H2/i2D,5D,6D,9D,10D
InChIKey
BXGSQUNMZMHPKS-OUHXUHDZSA-N
Chemical Structure
2D Structure
2D structure of omega-Hydroxy Fentanyl-d5 (1.0mg/ml in Acetonitrile)
CAS: 1329643-24-4
CID: 71748859
Formula: C22H28N2O2
MW: 357.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight357.5
XLogP32.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count7
Exact Mass357.246461870
Monoisotopic Mass357.246461870
Topological Polar Surface Area43.8 Ų
Heavy Atom Count26
Formal Charge0
Complexity408
Isotope Atom Count5
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

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CS-TB-66196Omega-Hydroxy Fentanyl-d5
CS-TB-66195Omega-Hydroxy Fentanyl
469879-01ω-Hydroxy Fentanyl-d5 discontinued
469877-01ω-Hydroxy Fentanyl discontinued
CS-T-267331-Hydroxy Fentanyl
CS-BX-00496β-hydroxy Fentanyl hydrochloride
167334ω-1-Hydroxy Fentanyl discontinued
MBS6096615-01O-Benzyl-N-tert-butoxycarbonyl omega-Hydroxy Norfentanyl-d5
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