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Fentanyl Citrate

CAT: 0572-TRC-F275000-2.5MGSize: 2.5 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-F275000-2.5MGSize:2.5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
990-73-8
Synonyms
Propionanilide, N-(1-phenethyl-4-piperidyl)-, citrate (1:1) (8CI); Actiq; Duragesic; Fentanil citrate; Fentanyl citrate; Fentaz; Fentos Tape; Leptanal; Leptanol; McN-JR 4263; McN-JR 4263-49; N-(1-Phenethyl-4-piperidinyl)propionanilide dihydrogen citrate; N-(1-Phenethyl-4-piperidyl)propionanilide citrate; NasalFent; Onsolis; Oralet; Oravescent; Pentanyl; Phentanyl citrate; R 5240; Sublimaze
Hazard Statement
Fatal if swallowed; UN number: UN2811; Packing Group: II
Purity
>95% (HPLC)
Smiles
CCC(=O)N(C1CCN(CCc2ccccc2)CC1)c3ccccc3.OC(=O)CC(O)(CC(=O)O)C(=O)O
Molecular Formula
C22 H28 N2 O . C6 H8 O7
Molecular Weight
528.59
InChI
InChI=1S/C22H28N2O.C6H8O7/c1-2-22(25)24(20-11-7-4-8-12-20)21-14-17-23(18-15-21)16-13-19-9-5-3-6-10-19;7-3(8)1-6(13,5(11)12)2-4(9)10/h3-12,21H,2,13-18H2,1H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)
Additionnal Information
IUPAC name: 2-hydroxypropane-1,2,3-tricarboxylic acid;N-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

Fentanyl Citrate

Fentanyl citrate is the citric acid salt of fentanyl, comprising equimolar amounts of citric acid and fentanyl. A -opioid receptor agonist, it is a potent opioid analgesic used in the management of labour pain, postoperative pain, and chronic intractable cancer pain. It is also widely used as the analgesic component of balanced anaesthesia. It has a role as an opioid analgesic and a mu-opioid receptor agonist. It contains a fentanyl.

CAS Number990-73-8
PubChem CID13810
IUPAC Name2-hydroxypropane-1,2,3-tricarboxylic acid;N-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide
Molecular FormulaC28H36N2O8
Molecular Weight528.6
Topological Polar Surface Area156
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count9
Rotatable Bond Count11
Heavy Atom Count38
Formal Charge0
Complexity618
SMILES
CCC(=O)N(C1CCN(CC1)CCC2=CC=CC=C2)C3=CC=CC=C3.C(C(=O)O)C(CC(=O)O)(C(=O)O)O
InChI
InChI=1S/C22H28N2O.C6H8O7/c1-2-22(25)24(20-11-7-4-8-12-20)21-14-17-23(18-15-21)16-13-19-9-5-3-6-10-19;7-3(8)1-6(13,5(11)12)2-4(9)10/h3-12,21H,2,13-18H2,1H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)
InChIKey
IVLVTNPOHDFFCJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Fentanyl Citrate
CAS: 990-73-8
CID: 13810
Formula: C28H36N2O8
MW: 528.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight528.6
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count9
Rotatable Bond Count11
Exact Mass528.24716611
Monoisotopic Mass528.24716611
Topological Polar Surface Area156 Ų
Heavy Atom Count38
Formal Charge0
Complexity618
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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