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DL-Phenylephrine HCl

CAT: 0013-GTR19206763-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19206763-02Size:50 mg
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Description
DL-Phenylephrine hydrochloride is a selective α1-adrenergic receptor agonist. It is widely used in pharmacological research to study vasoconstriction, blood pressure regulation, and adrenergic signaling pathways in both in vitro and in vivo experimental models.
CAS Number
154-86-9
Field of Research
Neuroscience, Pharmacology & Drug Discovery
Smiles
Cl.OC1=CC=CC (=C1) C (O) CNC
Molecular Formula
C9H14ClNO2
Molecular Weight
203.67
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Phenylephrine hydrochloride, (+-)-
CAS Number154-86-9
PubChem CID6102
IUPAC Name3-[1-hydroxy-2-(methylamino)ethyl]phenol;hydrochloride
Molecular FormulaC9H14ClNO2
Molecular Weight203.66
Topological Polar Surface Area52.5
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count13
Formal Charge0
Complexity130
SMILES
CNCC(C1=CC(=CC=C1)O)O.Cl
InChI
InChI=1S/C9H13NO2.ClH/c1-10-6-9(12)7-3-2-4-8(11)5-7;/h2-5,9-12H,6H2,1H3;1H
InChIKey
OCYSGIYOVXAGKQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Phenylephrine hydrochloride, (+-)-
CAS: 154-86-9
CID: 6102
Formula: C9H14ClNO2
MW: 203.66
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight203.66
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass203.0713064
Monoisotopic Mass203.0713064
Topological Polar Surface Area52.5 Ų
Heavy Atom Count13
Formal Charge0
Complexity130
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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