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Gemfibrozil-d6

CAT: 1596-AR-G02183-02Size: 25 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-G02183-02Size:25 Units
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CAS Number
1184986-45-5
Synonyms
5- (2,5-dimethylphenoxy) -2,2-bis (methyl-d3) pentanoic acid
Molecular Formula
C15H16D6O3
Molecular Weight
256.37
API Name
Gemfibrozil

Chemical Information

Gemfibrozil-d6
CAS Number1184986-45-5
PubChem CID45039338
IUPAC Name5-(2,5-dimethylphenoxy)-2,2-bis(trideuteriomethyl)pentanoic acid
Molecular FormulaC15H22O3
Molecular Weight256.37
XLogP3.8
Topological Polar Surface Area46.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Heavy Atom Count18
Formal Charge0
Complexity273
SMILES
[2H]C([2H])([2H])C(CCCOC1=C(C=CC(=C1)C)C)(C(=O)O)C([2H])([2H])[2H]
InChI
InChI=1S/C15H22O3/c1-11-6-7-12(2)13(10-11)18-9-5-8-15(3,4)14(16)17/h6-7,10H,5,8-9H2,1-4H3,(H,16,17)/i3D3,4D3
InChIKey
HEMJJKBWTPKOJG-LIJFRPJRSA-N
Chemical Structure
2D Structure
2D structure of Gemfibrozil-d6
CAS: 1184986-45-5
CID: 45039338
Formula: C15H22O3
MW: 256.37
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight256.37
XLogP33.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Exact Mass256.194555035
Monoisotopic Mass256.194555035
Topological Polar Surface Area46.5 Ų
Heavy Atom Count18
Formal Charge0
Complexity273
Isotope Atom Count6
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

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AR-G01229-01Gemfibrozil Related Compound A
AR-G01234-01Gemfibrozil EP Impurity A
AR-G01226-01Gemfibrozil Acyl Glucuronide
AR-G01671-01Gemfibrozil EP Impurity D
AR-G02181-01Gemfibrozil EP Impurity F
AR-G01228-01Gemfibrozil EP Impurity D
AR-G01672-01Gemfibrozil EP Impurity E
AR-G01673-01Gemfibrozil EP Impurity H

Alternative Products

CatalogName
CS-O-02962Gemfibrozil-d6
HY-B0258S1Gemfibrozil-d6-1
MG07428-01Gemfibrozil b-D-glucuronide-D6
sc-280723Gemfibrozil 1-O-β-Glucuronide-d6
TRC-G305762-10MGGemfibrozil 1-O-Beta-Glucuronide-d6
FD23652-01Gemfibrozil

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