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2,5-Dimethoxy-4-propylphenethylamine

CAT: 0926-FD171569-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0926-FD171569-01Size:1 mg
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CAS Number
207740-22-5
Smiles
CCCC1=CC (=C (C=C1OC) CCN) OC
Molecular Formula
C13H21NO2
Molecular Weight
223.31 g/mol
Controlled
Yes

Chemical Information

2,5-Dimethoxy-4-propylphenethylamine

2-(2,5-Dimethoxy-4-(n)-propylphenyl)ethanamine is a DEA Schedule I controlled substance. Substances in the DEA Schedule I have no currently accepted medical use in the United States, a lack of accepted safety for use under medical supervision, and a high potential for abuse. It is a Hallucinogenic substances substance.

CAS Number207740-22-5
PubChem CID44350080
IUPAC Name2-(2,5-dimethoxy-4-propylphenyl)ethanamine
Molecular FormulaC13H21NO2
Molecular Weight223.31
XLogP2.5
Topological Polar Surface Area44.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Heavy Atom Count16
Formal Charge0
Complexity187
SMILES
CCCC1=CC(=C(C=C1OC)CCN)OC
InChI
InChI=1S/C13H21NO2/c1-4-5-10-8-13(16-3)11(6-7-14)9-12(10)15-2/h8-9H,4-7,14H2,1-3H3
InChIKey
PZJOKFZGPTVNBF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,5-Dimethoxy-4-propylphenethylamine
CAS: 207740-22-5
CID: 44350080
Formula: C13H21NO2
MW: 223.31
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight223.31
XLogP32.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Exact Mass223.157228913
Monoisotopic Mass223.157228913
Topological Polar Surface Area44.5 Ų
Heavy Atom Count16
Formal Charge0
Complexity187
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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