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Etilefrine hydrochloride

CAT: 1410-M16754-01Size: 1 EachDry Ice: NoHazardous: No
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Description
Etilefrine is a cardiac stimulant used as anantihypotensive.
CAS Number
943-17-9
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
217.69
Molecular Formula
C10H16ClNO2
Notes
Research use only, not for human use.
Receptor
Others

Chemical Information

Etilefrine Hydrochloride

Etilefrine hydrochloride (TN) is a member of phenols.

CAS Number943-17-9
PubChem CID164652
IUPAC Name3-[2-(ethylamino)-1-hydroxyethyl]phenol;hydrochloride
Molecular FormulaC10H16ClNO2
Molecular Weight217.69
Topological Polar Surface Area52.5
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count14
Formal Charge0
Complexity141
SMILES
CCNCC(C1=CC(=CC=C1)O)O.Cl
InChI
InChI=1S/C10H15NO2.ClH/c1-2-11-7-10(13)8-4-3-5-9(12)6-8;/h3-6,10-13H,2,7H2,1H3;1H
InChIKey
KTNROWWHOBZQGK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Etilefrine Hydrochloride
CAS: 943-17-9
CID: 164652
Formula: C10H16ClNO2
MW: 217.69
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight217.69
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass217.0869564
Monoisotopic Mass217.0869564
Topological Polar Surface Area52.5 Ų
Heavy Atom Count14
Formal Charge0
Complexity141
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