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12-Hydroxydodecanoic acid

CAT: 0024-sc-237813Size: 1 gDry Ice: NoHazardous: No
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CAT#:0024-sc-237813Size:1 g
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CAS Number
505-95-3

Chemical Information

12-Hydroxydodecanoic Acid

12-hydroxylauric acid is a medium-chain fatty acid that is the 12-hydroxylated derivative of lauric acid. It has a role as a human metabolite. It is functionally related to a dodecanoic acid. It is a conjugate acid of a 12-hydroxylaurate.

CAS Number505-95-3
PubChem CID79034
IUPAC Name12-hydroxydodecanoic acid
Molecular FormulaC12H24O3
Molecular Weight216.32
XLogP3.6
Topological Polar Surface Area57.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count11
Heavy Atom Count15
Formal Charge0
Complexity146
SMILES
C(CCCCCC(=O)O)CCCCCO
InChI
InChI=1S/C12H24O3/c13-11-9-7-5-3-1-2-4-6-8-10-12(14)15/h13H,1-11H2,(H,14,15)
InChIKey
ZDHCZVWCTKTBRY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 12-Hydroxydodecanoic Acid
CAS: 505-95-3
CID: 79034
Formula: C12H24O3
MW: 216.32
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight216.32
XLogP33.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count11
Exact Mass216.17254462
Monoisotopic Mass216.17254462
Topological Polar Surface Area57.5 Ų
Heavy Atom Count15
Formal Charge0
Complexity146
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