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Midodrine-D6 Hcl

CAT: 1299-RM-M090427-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-M090427-01Size:10 mg
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CAS Number
1188265-43-1
Synonyms
Midodrine-D6 HCl
Molecular Formula
C12H12D6N2O4
Molecular Weight
296.78
Target Alternative Name
Midodrine
Product Name Synonym
Midodrine-D6 HCl

Chemical Information

Midodrine D6 Hydrochloride
CAS Number1188265-43-1
PubChem CID45359028
IUPAC Name2-amino-N-[2-[2,5-bis(trideuteriomethoxy)phenyl]-2-hydroxyethyl]acetamide;hydrochloride
Molecular FormulaC12H19ClN2O4
Molecular Weight296.78
Topological Polar Surface Area93.8
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Heavy Atom Count19
Formal Charge0
Complexity262
SMILES
[2H]C([2H])([2H])OC1=CC(=C(C=C1)OC([2H])([2H])[2H])C(CNC(=O)CN)O.Cl
InChI
InChI=1S/C12H18N2O4.ClH/c1-17-8-3-4-11(18-2)9(5-8)10(15)7-14-12(16)6-13;/h3-5,10,15H,6-7,13H2,1-2H3,(H,14,16);1H/i1D3,2D3;
InChIKey
MGCQZNBCJBRZDT-TXHXQZCNSA-N
Chemical Structure
2D Structure
2D structure of Midodrine D6 Hydrochloride
CAS: 1188265-43-1
CID: 45359028
Formula: C12H19ClN2O4
MW: 296.78
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight296.78
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass296.1409953
Monoisotopic Mass296.1409953
Topological Polar Surface Area93.8 Ų
Heavy Atom Count19
Formal Charge0
Complexity262
Isotope Atom Count6
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes