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4-Ethoxyphenethylamine

CAT: 0024-sc-284223ASize: 5 gDry Ice: NoHazardous: No
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CAT#:0024-sc-284223ASize:5 g
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CAS Number
56370-30-0

Chemical Information

4-Ethoxyphenethylamine hydrochloride
CAS Number56370-30-0
PubChem CID12224549
IUPAC Name2-(4-ethoxyphenyl)ethanamine;hydrochloride
Molecular FormulaC10H16ClNO
Molecular Weight201.69
Topological Polar Surface Area35.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Heavy Atom Count13
Formal Charge0
Complexity108
SMILES
CCOC1=CC=C(C=C1)CCN.Cl
InChI
InChI=1S/C10H15NO.ClH/c1-2-12-10-5-3-9(4-6-10)7-8-11;/h3-6H,2,7-8,11H2,1H3;1H
InChIKey
LGGGIJHFLLDSKJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-Ethoxyphenethylamine hydrochloride
CAS: 56370-30-0
CID: 12224549
Formula: C10H16ClNO
MW: 201.69
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight201.69
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass201.0920418
Monoisotopic Mass201.0920418
Topological Polar Surface Area35.3 Ų
Heavy Atom Count13
Formal Charge0
Complexity108
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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