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10-Methylundecanoic acid

CAT: 0804-HY-W836817-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-W836817-01Size:5 mg
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Description
10-Methylundecanoic acid is an ester product.
CAS Number
2724-56-3
UNSPSC
12352211
Target
Biochemical Assay Reagents
Type
Natural Products
Related Pathways
Others
Applications
Metabolism-sugar/lipid metabolism
Field of Research
Metabolic Disease
Assay Protocol
https://www.medchemexpress.com/10-methylundecanoic-acid.html
Smiles
O=C(O)CCCCCCCCC(C)C
Molecular Formula
C12H24O2
Molecular Weight
200.32
Shipping Conditions
Room temperature
Scientific Category
Natural Products
Clinical Information
No Development Reported

Chemical Information

10-Methylundecanoic acid

10-methylundecanoic acid is a methyl-branched fatty acid that is undecanoic acid substituted by a methyl group at position 10. It is a branched-chain saturated fatty acid, a medium-chain fatty acid and a methyl-branched fatty acid. It is functionally related to an undecanoic acid.

CAS Number2724-56-3
PubChem CID75942
IUPAC Name10-methylundecanoic acid
Molecular FormulaC12H24O2
Molecular Weight200.32
XLogP4.9
Topological Polar Surface Area37.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count9
Heavy Atom Count14
Formal Charge0
Complexity141
SMILES
CC(C)CCCCCCCCC(=O)O
InChI
InChI=1S/C12H24O2/c1-11(2)9-7-5-3-4-6-8-10-12(13)14/h11H,3-10H2,1-2H3,(H,13,14)
InChIKey
QJRRBVNPIKYRQJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 10-Methylundecanoic acid
CAS: 2724-56-3
CID: 75942
Formula: C12H24O2
MW: 200.32
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight200.32
XLogP34.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count9
Exact Mass200.177630004
Monoisotopic Mass200.177630004
Topological Polar Surface Area37.3 Ų
Heavy Atom Count14
Formal Charge0
Complexity141
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