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16-Mercaptopalmitic acid

CAT: 0804-HY-137247-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-137247-01Size:100 mg
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Description
16-Mercaptopalmitic acid is a chain alkylmercaptan with a long -CH2 group that forms a self-assembled monolayer (SAM) on a variety of substrates[1][2].
CAS Number
69839-68-5
UNSPSC
12352211
Hazard Statement
H315, H319, H372, H413
Target
Biochemical Assay Reagents
Related Pathways
Others
Field of Research
Others
Purity
97.62
Smiles
O=C(O)CCCCCCCCCCCCCCCS
Molecular Formula
C16H32O2S
Molecular Weight
288.49
Precautions
H315, H319, H372, H413
References & Citations
[1]Livni E, et al. Synthesis and biologic distribution of mercapto derivatives of palmitic acid. J Med Chem. 1979 May;22 (5) :580-3. |[2]Abdulrahman H B, et al. Modification of surfaces of silver nanoparticles for controlled deposition of silicon, manganese, and titanium dioxides[J]. Applied Surface Science, 2018, 427: 334-339.
Shipping Conditions
Room Temperature
Storage Conditions
RT, stored under nitrogen
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

16-Mercaptohexadecanoic acid
CAS Number69839-68-5
PubChem CID3522585
IUPAC Name16-sulfanylhexadecanoic acid
Molecular FormulaC16H32O2S
Molecular Weight288.5
XLogP5.7
Topological Polar Surface Area38.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count15
Heavy Atom Count19
Formal Charge0
Complexity195
SMILES
C(CCCCCCCC(=O)O)CCCCCCCS
InChI
InChI=1S/C16H32O2S/c17-16(18)14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-19/h19H,1-15H2,(H,17,18)
InChIKey
INOAASCWQMFJQA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 16-Mercaptohexadecanoic acid
CAS: 69839-68-5
CID: 3522585
Formula: C16H32O2S
MW: 288.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight288.5
XLogP35.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count15
Exact Mass288.21230143
Monoisotopic Mass288.21230143
Topological Polar Surface Area38.3 Ų
Heavy Atom Count19
Formal Charge0
Complexity195
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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