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3-Methoxytyramine-d4 HCl

CAT: 0607-SL1016-1Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0607-SL1016-1Size:1 mg
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Description
A stable isotope deuterated compound of 3-Methoxytyramine HCl
CAS Number
1216788-76-9
Product Name Alternative
4- (2-aminoethyl-1,1,2,2-d4) -2-methoxyphenol hydrochloride
Smiles
OC1=C (OC) C=C (C ([2H]) ([2H]) C ([2H]) ([2H]) N) C=C1.[H]Cl
Molecular Formula
C9H9D4NO2 · HCl
Molecular Weight
207.69
Storage Conditions
Store at -20°C

Chemical Information

3-Methoxy Dopamine-d4 Hydrochloride
CAS Number1216788-76-9
PubChem CID46782154
IUPAC Name4-(2-amino-1,1,2,2-tetradeuterioethyl)-2-methoxyphenol;hydrochloride
Molecular FormulaC9H14ClNO2
Molecular Weight207.69
Topological Polar Surface Area55.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count13
Formal Charge0
Complexity130
SMILES
[2H]C([2H])(C1=CC(=C(C=C1)O)OC)C([2H])([2H])N.Cl
InChI
InChI=1S/C9H13NO2.ClH/c1-12-9-6-7(4-5-10)2-3-8(9)11;/h2-3,6,11H,4-5,10H2,1H3;1H/i4D2,5D2;
InChIKey
AWRIOTVUTPLWLF-HGFPCDIYSA-N
Chemical Structure
2D Structure
2D structure of 3-Methoxy Dopamine-d4 Hydrochloride
CAS: 1216788-76-9
CID: 46782154
Formula: C9H14ClNO2
MW: 207.69
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight207.69
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass207.0964134
Monoisotopic Mass207.0964134
Topological Polar Surface Area55.5 Ų
Heavy Atom Count13
Formal Charge0
Complexity130
Isotope Atom Count4
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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Alternative Products

CatalogName
HY-103638S-013-Methoxytyramine-d4 (hydrochloride)
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A21676-1003-Methoxytyramine 100mg
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