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4-Hydroxy Mepivacaine-d3

CAT: 0804-HY-132439S-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-132439S-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
4-Hydroxy Mepivacaine-d3 is the deuterium labeled 4-Hydroxy Mepivacaine[1].
CAS Number
1323251-06-4
UNSPSC
12352005
Target
Isotope-Labeled Compounds
Type
Isotope-Labeled Compounds
Related Pathways
Others
Field of Research
Others
Solubility
10 mM in DMSO
Smiles
N(C(=O)C1N(C([2H])([2H])[2H])CCCC1)C2=C(C)C=C(O)C=C2C
Molecular Formula
C15H19D3N2O2
Molecular Weight
265.37
References & Citations
[1]Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019;53 (2) :211-216.
Shipping Conditions
Room temperature
Scientific Category
Isotope-Labeled Compounds
Clinical Information
No Development Reported

Chemical Information

4-Hydroxy Mepivacaine-d3
CAS Number1323251-06-4
PubChem CID71748870
IUPAC NameN-(4-hydroxy-2,6-dimethylphenyl)-1-(trideuteriomethyl)piperidine-2-carboxamide
Molecular FormulaC15H22N2O2
Molecular Weight265.37
XLogP1.6
Topological Polar Surface Area52.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count19
Formal Charge0
Complexity309
SMILES
[2H]C([2H])([2H])N1CCCCC1C(=O)NC2=C(C=C(C=C2C)O)C
InChI
InChI=1S/C15H22N2O2/c1-10-8-12(18)9-11(2)14(10)16-15(19)13-6-4-5-7-17(13)3/h8-9,13,18H,4-7H2,1-3H3,(H,16,19)/i3D3
InChIKey
FBFWYQLEUFLRTK-HPRDVNIFSA-N
Chemical Structure
2D Structure
2D structure of 4-Hydroxy Mepivacaine-d3
CAS: 1323251-06-4
CID: 71748870
Formula: C15H22N2O2
MW: 265.37
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight265.37
XLogP31.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass265.186958187
Monoisotopic Mass265.186958187
Topological Polar Surface Area52.6 Ų
Heavy Atom Count19
Formal Charge0
Complexity309
Isotope Atom Count3
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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MBS6042883-014-Hydroxy Mepivacaine-d3
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