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Undecanedioic acid

CAT: 0013-GTR19169622-02Size: 2 gDry Ice: NoHazardous: No
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CAT#:0013-GTR19169622-02Size:2 g
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Description
Undecanedioic acid
CAS Number
1852-04-6
Product Name Alternative
Undecanedioic acid, Inhibitor, EndogenousMetabolite, Endogenous Metabolite, inhibit
Field of Research
Metabolism Research
Purity
98.00% (May vary between batches)
Solubility
Methanol:10 mg/mL (46.24 mM)
Smiles
C (CC (O) =O) CCCCCCCC (O) =O
Molecular Formula
C11H20O4
Molecular Weight
216.27
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Undecanedioic Acid

Undecanedioic acid is an alpha,-dicarboxylic acid that is nonane with two carboxylic acid groups at positions C-1 and C-9. It has a role as a metabolite. It is a conjugate acid of an undecanedioic acid anion.

CAS Number1852-04-6
PubChem CID15816
IUPAC Nameundecanedioic acid
Molecular FormulaC11H20O4
Molecular Weight216.27
XLogP2.7
Topological Polar Surface Area74.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count10
Heavy Atom Count15
Formal Charge0
Complexity169
SMILES
C(CCCCC(=O)O)CCCCC(=O)O
InChI
InChI=1S/C11H20O4/c12-10(13)8-6-4-2-1-3-5-7-9-11(14)15/h1-9H2,(H,12,13)(H,14,15)
InChIKey
LWBHHRRTOZQPDM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Undecanedioic Acid
CAS: 1852-04-6
CID: 15816
Formula: C11H20O4
MW: 216.27
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight216.27
XLogP32.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count10
Exact Mass216.13615911
Monoisotopic Mass216.13615911
Topological Polar Surface Area74.6 Ų
Heavy Atom Count15
Formal Charge0
Complexity169
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

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