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3-Hydroxydecanoic acid 5mg

CAT: 0628-A18903-5Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0628-A18903-5Size:5 mg
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CAS Number
14292-26-3

Chemical Information

3-Hydroxydecanoic acid

3-hydroxydecanoic acid is a medium-chain fatty acid that is decanoic acid substituted at position 3 by a hydroxy group. It has a role as an antimitotic and an Escherichia coli metabolite. It is a medium-chain fatty acid and a 3-hydroxy fatty acid. It is functionally related to a decanoic acid. It is a conjugate acid of a 3-hydroxydecanoate.

CAS Number14292-26-3
PubChem CID26612
IUPAC Name3-hydroxydecanoic acid
Molecular FormulaC10H20O3
Molecular Weight188.26
XLogP2.5
Topological Polar Surface Area57.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count8
Heavy Atom Count13
Formal Charge0
Complexity134
SMILES
CCCCCCCC(CC(=O)O)O
InChI
InChI=1S/C10H20O3/c1-2-3-4-5-6-7-9(11)8-10(12)13/h9,11H,2-8H2,1H3,(H,12,13)
InChIKey
FYSSBMZUBSBFJL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-Hydroxydecanoic acid
CAS: 14292-26-3
CID: 26612
Formula: C10H20O3
MW: 188.26
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight188.26
XLogP32.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count8
Exact Mass188.14124450
Monoisotopic Mass188.14124450
Topological Polar Surface Area57.5 Ų
Heavy Atom Count13
Formal Charge0
Complexity134
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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