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Fenoterol EP Impurity B HCl

CAT: 1596-AR-F01311-01Size: 10 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-F01311-01Size:10 Units
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CAS Number
1944-11-2
Synonyms
1- (3,5-dihydroxyphenyl) -2- ((1- (4-hydroxyphenyl) propan-2-yl) amino) ethanone hydrochloride
Molecular Formula
C17H19NO4. HCl
Molecular Weight
301.35 36.46
API Name
Fenoterol

Chemical Information

1-(3,5-Dihydroxyphenyl)-2-[1-(4-hydroxyphenyl)propan-2-ylamino]ethanone;hydrochloride
CAS Number1944-11-2
PubChem CID176484474
IUPAC Name1-(3,5-dihydroxyphenyl)-2-[1-(4-hydroxyphenyl)propan-2-ylamino]ethanone;hydrochloride
Molecular FormulaC17H20ClNO4
Molecular Weight337.8
Topological Polar Surface Area89.8
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Heavy Atom Count23
Formal Charge0
Complexity345
SMILES
CC(CC1=CC=C(C=C1)O)NCC(=O)C2=CC(=CC(=C2)O)O.Cl
InChI
InChI=1S/C17H19NO4.ClH/c1-11(6-12-2-4-14(19)5-3-12)18-10-17(22)13-7-15(20)9-16(21)8-13;/h2-5,7-9,11,18-21H,6,10H2,1H3;1H
InChIKey
HYIMJIJRUZFTDC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-(3,5-Dihydroxyphenyl)-2-[1-(4-hydroxyphenyl)propan-2-ylamino]ethanone;hydrochloride
CAS: 1944-11-2
CID: 176484474
Formula: C17H20ClNO4
MW: 337.8
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight337.8
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass337.1080858
Monoisotopic Mass337.1080858
Topological Polar Surface Area89.8 Ų
Heavy Atom Count23
Formal Charge0
Complexity345
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