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5-(4-Morpholinylmethyl)-d2 Delta-Tocopherol, 90%

CAT: 0572-TRC-M723792-50MGSize: 50 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-M723792-50MGSize:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
936230-74-9
Synonyms
(2R)-3,4-Dihydro-2,8-dimethyl-5-(4-morpholinylmethyl-d2)-2-[(4R,8R)-4,8,12-trimethyltridecyl]-2H-1-benzopyran-6-ol;
Hazard Statement
No Data Available
Smiles
OC1=C(C([2H])([2H])N2CCOCC2)C(CC[C@](CCCC(C)CCCC(C)CCCC(C)C)(C)O3)=C3C(C)=C1
Molecular Formula
C32H53D2NO3
Molecular Weight
503.8
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

5-(4-Morpholinylmethyl)-d2 delta-Tocopherol
CAS Number936230-74-9
PubChem CID169444393
IUPAC Name(2R)-5-[dideuterio(morpholin-4-yl)methyl]-2,8-dimethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-ol
Molecular FormulaC32H55NO3
Molecular Weight503.8
XLogP9.4
Topological Polar Surface Area41.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count14
Heavy Atom Count36
Formal Charge0
Complexity606
SMILES
[2H]C([2H])(C1=C(C=C(C2=C1CC[C@@](O2)(C)CCCC(C)CCCC(C)CCCC(C)C)C)O)N3CCOCC3
InChI
InChI=1S/C32H55NO3/c1-24(2)10-7-11-25(3)12-8-13-26(4)14-9-16-32(6)17-15-28-29(23-33-18-20-35-21-19-33)30(34)22-27(5)31(28)36-32/h22,24-26,34H,7-21,23H2,1-6H3/t25?,26?,32-/m1/s1/i23D2
InChIKey
NHGONPYIGRKKFZ-KBAZJMJSSA-N
Chemical Structure
2D Structure
2D structure of 5-(4-Morpholinylmethyl)-d2 delta-Tocopherol
CAS: 936230-74-9
CID: 169444393
Formula: C32H55NO3
MW: 503.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight503.8
XLogP39.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count14
Exact Mass503.43074811
Monoisotopic Mass503.43074811
Topological Polar Surface Area41.9 Ų
Heavy Atom Count36
Formal Charge0
Complexity606
Isotope Atom Count2
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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