Biotin-PFP ester

• CAS: 120550-35-8
• Catalog Number: ACM120550358
• Category: Other Products; Biotin PEG Linkers
• Molecular Weight: 410.36 g/mol
• Molecular Formula: C16H15F5N2O3S
• Synonyms: Biotin-PFP ester
• IUPAC Name: perfluorophenyl 5-((3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanoate
• Canonical SMILES: O=C1N[C@@]2([H])CS[C@@H](CCCCC(OC3=C(F)C(F)=C(F)C(F)=C3F)=O)[C@@]2([H])N1
• InChI: InChI=1S/C16H15F5N2O3S/c17-9-10(18)12(20)15(13(21)11(9)19)26-8(24)4-2-1-3-7-14-6(5-27-7)22-16(25)23-14/h6-7,14H,1-5H2,(H2,22,23,25)/t6-,7-,14-/m0/s1
• InChI Key: DKTMDBQDSYQUEV-LEJLMFORSA-N
• Appearance: Solid powder
• Shelf Life: >3 years if stored properly
• Storage: Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
• Drug Formulation: This drug may be formulated in DMSO
• Elemental Analysis: C, 46.83; H, 3.68; F, 23.15; N, 6.83; O, 11.70; S, 7.81
• Exact Mass: 410.0724
• HS Tariff Code: 2934.99.03.00
• Shipping: Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
• Stock Solution Storage: 0 - 4 C for short term (days to weeks), or -20 C for long term (months).

Synthetic Use

Upstream Synthesis Route 1

• 771-61-9
• 58-85-5

• 120550-35-8

Reference: [1] Synthetic Communications, 1996, vol. 26, # 13, p. 2531 - 2547

Upstream Synthesis Route 2

• 14533-84-7
• 58-85-5

• 120550-35-8

Reference: [1] Organic Letters, 2013, vol. 15, # 6, p. 1406 - 1409

Upstream Synthesis Route 3

• 58-85-5

• 120550-35-8

Reference: [1] Organic and Biomolecular Chemistry, 2010, vol. 8, # 18, p. 4059 - 4062

Upstream Synthesis Route 4

• 14533-84-7
• 58-85-5

• 120550-35-8

Reference: [1]Patent: WO2018/207077,2018,A1 .Location in patent: Paragraph 0082

Upstream Synthesis Route 5

• 59483-84-0
• 58-85-5

• 120550-35-8

Reference: [1]Chemistry of Natural Compounds,1989,vol. 25,p. 350 - 353
Khimiya Prirodnykh Soedinenii,1989,p. 404 - 408