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3-Methoxy Acetaminophen-d3

CAT: 0572-TRC-M226052-50MGSize: 50 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-M226052-50MGSize:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1246816-53-4
Synonyms
4-Acetylamino-2-methoxy-phenol-d3; N-(4-Hydroxy-3-methoxy-phenyl)-acetamide-d3; Acetic Acid-(4-hydroxy-3-methoxyanilide)-d3; N-(4-Hydroxy-3-methoxyphenyl)acetamide-2,2,2-D3; 2,2,2-Trideuterio-N-(4-hydroxy-3-methoxyphenyl)acetamide; 4'-Hydroxy-m-acetanisidide-d3; N-(4-Hydroxy-3-methoxyphenyl)acetamide-2,2,2-d3; N-(4-Hydroxy-3-methoxyphenyl)acetamide-d3; N-(4-Hydroxy-3-methoxyphenyl)acetamide-2,2,2-D3; 3-Methoxyacetaminophen-d3; 3-Methoxy acetaminophen-d3; 3-Methoxyparacetamol-d3; 3-Methoxy paracetamol-d3; 4-(Acetamido-d3)-2-methoxyphenol; 4-(Acetyl-d3-amino)-2-methoxyphenol
Hazard Statement
Harmful if swallowed.
Purity
>95% (HPLC)
Smiles
[2H]C([2H])([2H])C(=O)Nc1ccc(O)c(OC)c1
Molecular Formula
C9 2H3 H8 N O3
Molecular Weight
184.207
InChI
InChI=1S/C9H11NO3/c1-6(11)10-7-3-4-8(12)9(5-7)13-2/h3-5,12H,1-2H3,(H,10,11)/i1D3
Additionnal Information
IUPAC name: 2,2,2-trideuterio-N-(4-hydroxy-3-methoxy-phenyl)acetamide
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

3-Methoxy Acetaminophen-d3
CAS Number1246816-53-4
PubChem CID71749995
IUPAC Name2,2,2-trideuterio-N-(4-hydroxy-3-methoxyphenyl)acetamide
Molecular FormulaC9H11NO3
Molecular Weight184.21
XLogP0
Topological Polar Surface Area58.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count13
Formal Charge0
Complexity184
SMILES
[2H]C([2H])([2H])C(=O)NC1=CC(=C(C=C1)O)OC
InChI
InChI=1S/C9H11NO3/c1-6(11)10-7-3-4-8(12)9(5-7)13-2/h3-5,12H,1-2H3,(H,10,11)/i1D3
InChIKey
KIZWIAQUWRXFNC-FIBGUPNXSA-N
Chemical Structure
2D Structure
2D structure of 3-Methoxy Acetaminophen-d3
CAS: 1246816-53-4
CID: 71749995
Formula: C9H11NO3
MW: 184.21
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight184.21
XLogP30
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass184.092723451
Monoisotopic Mass184.092723451
Topological Polar Surface Area58.6 Ų
Heavy Atom Count13
Formal Charge0
Complexity184
Isotope Atom Count3
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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RM-U180146-01Urapidil-D3 (Methoxy-D3)
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