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Dipalmitin

CAT: 0926-BBA65795-04Size: 1000 mgDry Ice: NoHazardous: No
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CAT#:0926-BBA65795-04Size:1000 mg
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CAS Number
26657-95-4
MDL Number
MFCD00216843
Smiles
CCCCCCCCCCCCCCCC (=O) OCC (CO) OC (=O) CCCCCCCCCCCCCCC.CCCCCCCCCCCCCCCC (=O) OCC (COC (=O) CCCCCCCCCCCCCCC) O
Molecular Formula
C35H68O5
Molecular Weight
568.91 g/mol
Controlled
No

Chemical Information

Glycerol 1,2(3)-dihexadecanoate
CAS Number26657-95-4
PubChem CID71308681
IUPAC Name(2-hexadecanoyloxy-3-hydroxypropyl) hexadecanoate;(3-hexadecanoyloxy-2-hydroxypropyl) hexadecanoate
Molecular FormulaC70H136O10
Molecular Weight1137.8
Topological Polar Surface Area146
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count10
Rotatable Bond Count68
Heavy Atom Count80
Formal Charge0
Complexity1030
SMILES
CCCCCCCCCCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCCCCCCCCC.CCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCC)O
InChI
InChI=1S/2C35H68O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-34(37)39-31-33(36)32-40-35(38)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-34(37)39-32-33(31-36)40-35(38)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h2*33,36H,3-32H2,1-2H3
InChIKey
UJTQAHPLAOYWPB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Glycerol 1,2(3)-dihexadecanoate
CAS: 26657-95-4
CID: 71308681
Formula: C70H136O10
MW: 1137.8
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight1137.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count10
Rotatable Bond Count68
Exact Mass1137.01335053
Monoisotopic Mass1137.01335053
Topological Polar Surface Area146 Ų
Heavy Atom Count80
Formal Charge0
Complexity1030
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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