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Hexacosanedioicacid

CAT: 0127-OR1066709-02Size: 5 gDry Ice: NoHazardous: No
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CAT#:0127-OR1066709-02Size:5 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
3365-67-1
MDL Number
MFCD00673440
Purity
99%
Smiles
O=C(O)CCCCCCCCCCCCCCCCCCCCCCCCC(O)=O

Chemical Information

Hexacosanedioic acid

Hexacosanedioic acid is an alpha,-dicarboxylic acid that is hexacosane in which the methyl groups have been oxidised to the corresponding carboxylic acids. It is a dicarboxylic fatty acid and an alpha,omega-dicarboxylic acid. It is a conjugate acid of a hexacosanedioate(2-). It derives from a hydride of a hexacosane.

CAS Number3365-67-1
PubChem CID9543670
IUPAC Namehexacosanedioic acid
Molecular FormulaC26H50O4
Molecular Weight426.7
XLogP10.8
Topological Polar Surface Area74.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count25
Heavy Atom Count30
Formal Charge0
Complexity345
SMILES
C(CCCCCCCCCCCCC(=O)O)CCCCCCCCCCCC(=O)O
InChI
InChI=1S/C26H50O4/c27-25(28)23-21-19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18-20-22-24-26(29)30/h1-24H2,(H,27,28)(H,29,30)
InChIKey
JJWZFUFNJNGKAF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Hexacosanedioic acid
CAS: 3365-67-1
CID: 9543670
Formula: C26H50O4
MW: 426.7
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight426.7
XLogP310.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count25
Exact Mass426.37091007
Monoisotopic Mass426.37091007
Topological Polar Surface Area74.6 Ų
Heavy Atom Count30
Formal Charge0
Complexity345
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
HY-W613967-01Hexacosanedioicacid

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