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Metrazoline

CAT: 0931-T204804-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T204804-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
221225-04-3
Target
Adrenergic Receptor, Imidazoline Receptor
Related Pathways
GPCR/G Protein, Neuroscience
Bioactivity
Metrazoline (o-Methyl-tracizoline) acts as a ligand for adrenergic receptors (low affinity) and imidazoline I2 receptors.
Smiles
C(C(O)=O)(O)=O.C(=C/C=1NCCN1)\C2=C(C)C=CC=C2
Molecular Formula
C14H16N2O4
Molecular Weight
276.288
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Metrazoline oxalate
CAS Number221225-04-3
PubChem CID11957617
IUPAC Name2-[(E)-2-(2-methylphenyl)ethenyl]-4,5-dihydro-1H-imidazole;oxalic acid
Molecular FormulaC14H16N2O4
Molecular Weight276.29
Topological Polar Surface Area99
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count20
Formal Charge0
Complexity314
SMILES
CC1=CC=CC=C1/C=C/C2=NCCN2.C(=O)(C(=O)O)O
InChI
InChI=1S/C12H14N2.C2H2O4/c1-10-4-2-3-5-11(10)6-7-12-13-8-9-14-12;3-1(4)2(5)6/h2-7H,8-9H2,1H3,(H,13,14);(H,3,4)(H,5,6)/b7-6+;
InChIKey
QDUUQIGHAAEJDO-UHDJGPCESA-N
Chemical Structure
2D Structure
2D structure of Metrazoline oxalate
CAS: 221225-04-3
CID: 11957617
Formula: C14H16N2O4
MW: 276.29
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight276.29
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass276.11100700
Monoisotopic Mass276.11100700
Topological Polar Surface Area99 Ų
Heavy Atom Count20
Formal Charge0
Complexity314
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes