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Dipivefrine Hydrochloride

CAT: 0572-TRC-D492155-250MGSize: 250 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-D492155-250MGSize:250 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
64019-93-8
Synonyms
Dipivefrine hydrochloride; 4-[(1RS)-1-hydroxy-2-(methylamino)ethyl]-1,2-phenylene bis(2,2-dimethylpropanoate) hydrochloride; Propanoic acid, 2,2-dimethyl-, 1,1'-[4-[1-hydroxy-2-(methylamino)ethyl]-1,2-phenylene] ester, hydrochloride (1:1); Propanoic acid, 2,2-dimethyl-, 4-[1-hydroxy-2-(methylamino)ethyl]-1,2-phenylene ester, hydrochloride (9CI); Propanoic acid, 2,2-dimethyl-, 4-[1-hydroxy-2-(methylamino)ethyl]-1,2-phenylene ester, hydrochloride, (±)-; D Epifrin; Diopine; Diphemin; Dipivefrin hydrochloride; Dipivefrine hydrochloride; Pivalephrine; Propine
Hazard Statement
No Data Available
Smiles
Cl.CNCC(O)c1ccc(OC(=O)C(C)(C)C)c(OC(=O)C(C)(C)C)c1
Molecular Formula
C19 H29 N O5 . Cl H
Molecular Weight
387.9
InChI
InChI=1S/C19H29NO5.ClH/c1-18(2,3)16(22)24-14-9-8-12(13(21)11-20-7)10-15(14)25-17(23)19(4,5)6;/h8-10,13,20-21H,11H2,1-7H3;1H
Additionnal Information
IUPAC name: [2-(2,2-dimethylpropanoyloxy)-4-[1-hydroxy-2-(methylamino)ethyl]phenyl] 2,2-dimethylpropanoate;hydrochloride
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

Dipivefrin Hydrochloride

Dipivefrin hydrochloride is the hydrochloride salt of dipivefrin. It is used topically as eye drops to reduce intra-ocular pressure in the treatment of open-angle glaucoma or ocular hypertension. It has a role as a sympathomimetic agent, an adrenergic agonist and an antiglaucoma drug. It contains a dipivefrin(1+).

CAS Number64019-93-8
PubChem CID71486
IUPAC Name[2-(2,2-dimethylpropanoyloxy)-4-[1-hydroxy-2-(methylamino)ethyl]phenyl] 2,2-dimethylpropanoate;hydrochloride
Molecular FormulaC19H30ClNO5
Molecular Weight387.9
Topological Polar Surface Area84.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count9
Heavy Atom Count26
Formal Charge0
Complexity463
SMILES
CC(C)(C)C(=O)OC1=C(C=C(C=C1)C(CNC)O)OC(=O)C(C)(C)C.Cl
InChI
InChI=1S/C19H29NO5.ClH/c1-18(2,3)16(22)24-14-9-8-12(13(21)11-20-7)10-15(14)25-17(23)19(4,5)6;/h8-10,13,20-21H,11H2,1-7H3;1H
InChIKey
VKFAUCPBMAGVRG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Dipivefrin Hydrochloride
CAS: 64019-93-8
CID: 71486
Formula: C19H30ClNO5
MW: 387.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight387.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count9
Exact Mass387.1812508
Monoisotopic Mass387.1812508
Topological Polar Surface Area84.9 Ų
Heavy Atom Count26
Formal Charge0
Complexity463
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
sc-497876Dipivefrine Hydrochloride
CS-O-44436Dipivefrine Hydrochloride-D3
AR-D07249-01Dipivefrine HCl
AR-D07245-01Dipivefrine-d3
RM-D091607-01N-nitroso-Dipivefrine
RM-D091601-01Dipivefrine EP Impurity A
AR-D07250-01Dipivefrine-d6 HCl
AR-D07251-01N-Nitroso Dipivefrine
AR-D07254-01Dipivefrine EP Impurity C HCl and Dipivefrine EP Impurity D HCl
RM-D091605-01Dipivefrine EP Impurity E

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