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N-Desmethylmethoxyphenamine

CAT: 0926-FN182365-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0926-FN182365-01Size:1 mg
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CAS Number
15402-84-3
Smiles
CC (CC1=CC=CC=C1OC) N
Molecular Formula
C10H15NO
Molecular Weight
165.23 g/mol
Controlled
Yes

Chemical Information

2-Methoxyamphetamine

metabolite of methoxyphenamine; RN given refers to parent cpd without isomeric designation

CAS Number15402-84-3
PubChem CID159755
IUPAC Name1-(2-methoxyphenyl)propan-2-amine
Molecular FormulaC10H15NO
Molecular Weight165.23
XLogP2.1
Topological Polar Surface Area35.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count12
Formal Charge0
Complexity127
SMILES
CC(CC1=CC=CC=C1OC)N
InChI
InChI=1S/C10H15NO/c1-8(11)7-9-5-3-4-6-10(9)12-2/h3-6,8H,7,11H2,1-2H3
InChIKey
VBAHFEPKESUPDE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Methoxyamphetamine
CAS: 15402-84-3
CID: 159755
Formula: C10H15NO
MW: 165.23
Interactive 3D Structure
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Computed Properties
PropertyValue
Molecular Weight165.23
XLogP32.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass165.115364102
Monoisotopic Mass165.115364102
Topological Polar Surface Area35.3 Ų
Heavy Atom Count12
Formal Charge0
Complexity127
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes