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(S)-(-)-Alpha-Lipoic Acid

CAT: 0572-TRC-L468730-25MGSize: 25 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-L468730-25MGSize:25 mg
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CAS Number
1077-27-6
Synonyms
(3S)-1,2-Dithiolane-3-pentanoic Acid; (-)-Thioctic Acid; (S)-(-)-Lipoic Acid; (S)-Lipoic Acid; (S)-Thioctic Acid; l-Thioctic Acid;
Hazard Statement
Harmful if swallowed; UN number: UN3077; Packing Group: III
Purity
>95% (HPLC)
Smiles
C1CSS[C@H]1CCCCC(=O)O
Molecular Formula
C8H14O2S2
Molecular Weight
206.33
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

(S)-lipoic acid

(S)-lipoic acid is the (S)-enantiomer of lipoic acid. Not found in nature, it may exert detrimental effects on biosystems. It is a lipoic acid, a member of dithiolanes, a heterocyclic fatty acid and a thia fatty acid. It is functionally related to an octanoic acid. It is an enantiomer of a (R)-lipoic acid.

CAS Number1077-27-6
PubChem CID445125
IUPAC Name5-[(3S)-dithiolan-3-yl]pentanoic acid
Molecular FormulaC8H14O2S2
Molecular Weight206.3
XLogP1.7
Topological Polar Surface Area87.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count12
Formal Charge0
Complexity150
SMILES
C1CSS[C@H]1CCCCC(=O)O
InChI
InChI=1S/C8H14O2S2/c9-8(10)4-2-1-3-7-5-6-11-12-7/h7H,1-6H2,(H,9,10)/t7-/m0/s1
InChIKey
AGBQKNBQESQNJD-ZETCQYMHSA-N
Chemical Structure
2D Structure
2D structure of (S)-lipoic acid
CAS: 1077-27-6
CID: 445125
Formula: C8H14O2S2
MW: 206.3
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight206.3
XLogP31.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass206.04352203
Monoisotopic Mass206.04352203
Topological Polar Surface Area87.9 Ų
Heavy Atom Count12
Formal Charge0
Complexity150
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes