methyl 8-(nonylsulfanyl)octanoate

• ChemBase ID: 133716
• Molecular Formular: C18H36O2S
• Molecular Mass: 316.54224
• Monoisotopic Mass: 316.24360139
• SMILES: CCCCCCCCCSCCCCCCCC(=O)OC
• Canonical SMILES: CCCCCCCCCSCCCCCCCC(=O)OC
• InChI: InChI=1S/C18H36O2S/c1-3-4-5-6-7-10-13-16-21-17-14-11-8-9-12-15-18(19)20-2/h3-17H2,1-2H3
• InChIKey: KOIAEPKOELHGSL-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: methyl 8-(nonylsulfanyl)octanoate
• IUPAC Traditional name: methyl 8-(nonylsulfanyl)octanoate
• Synonyms: Anti-TIMP-4; Anti-Tissue Inhibitor of Metalloproteinase-4, First Loop antibody produced in rabbit

Database IDs

• MDL Number: MFCD03097332
• PubChem SID: 162227993; 24900540
• PubChem CID: 4283518

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 6.490592
• LogD (pH = 7.4): 6.490592
• Log P: 6.490592
• Molar Refractivity: 94.5808 cm^3
• Polarizability: 37.71803 Å^3
• Polar Surface Area: 26.3 Å^2
• Rotatable Bonds: 17
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Apperance: buffered aqueous glycerol solution

Safety Information

• German water hazard class: 1
• Storage Temperature: -20°C

Pharmacology Properties

• Gene Information: human ... TIMP4(7079)

Product Information

• Concentration: ~1 mg/mL
• Application(s): western blot: 1:1,000
• Shipped in: wet ice
• Clone: polyclonal
• Species Reactivity: human
• Antibody Form: affinity isolated antibody

DETAILS

Sigma Aldrich - T8537

Immunogen
synthetic peptide corresponding to the first loop of human TIMP-4.
Specificity
Reacts with reduced and non-reduced TIMP-4. By immunoblotting against the reduced protein, the antibody reacts with bands at approximately 23 kDa and 29 kDa (unglycosylated and glycosylated, respectively).
Physical form
Solution in 0.01 M phosphate buffered saline, pH 7.4, containing 50% glycerol and 15 mM sodium azide.