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5-methoxy Methylone hydrochloride

CAT: 0931-TYD-02567-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-TYD-02567-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2702151-27-5
Target
Others
Related Pathways
Others
Bioactivity
5-methoxy Methylone hydrochloride is classified as a ksyton.
Smiles
Cl.O=C(C1=CC(OC)=C2OCOC2=C1)C(NC)C
Molecular Formula
C12H16ClNO4
Molecular Weight
273.71
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

1-(7-Methoxybenzo[d][1,3]dioxol-5-yl)-2-(methylamino)propan-1-one,mononhydrochloride
CAS Number2702151-27-5
PubChem CID132988633
IUPAC Name1-(7-methoxy-1,3-benzodioxol-5-yl)-2-(methylamino)propan-1-one;hydrochloride
Molecular FormulaC12H16ClNO4
Molecular Weight273.71
Topological Polar Surface Area56.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count18
Formal Charge0
Complexity284
SMILES
CC(C(=O)C1=CC2=C(C(=C1)OC)OCO2)NC.Cl
InChI
InChI=1S/C12H15NO4.ClH/c1-7(13-2)11(14)8-4-9(15-3)12-10(5-8)16-6-17-12;/h4-5,7,13H,6H2,1-3H3;1H
InChIKey
GNJPVPAVBRRRPU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-(7-Methoxybenzo[d][1,3]dioxol-5-yl)-2-(methylamino)propan-1-one,mononhydrochloride
CAS: 2702151-27-5
CID: 132988633
Formula: C12H16ClNO4
MW: 273.71
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight273.71
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass273.0767857
Monoisotopic Mass273.0767857
Topological Polar Surface Area56.8 Ų
Heavy Atom Count18
Formal Charge0
Complexity284
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

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Alternative Products

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