Propargyl-PEG5-t-butyl ester

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Propargyl-PEG5-t-butyl ester

Propargyl-PEG5-t-butyl ester | 1245823-50-0

Catalog Number R01-0173
Category Alkynes
Molecular Formula C18H32O7
Molecular Weight 360.44
Catalog Number Size Price Quantity
R01-0173 -- $--

Chemical Information

Synonyms Propargyl-PEG5-COOtBu; Propargyl-PEG4-CH2CH2-Boc; Propargyl-PEG4-Boc; Alkyne-PEG5-CH2CH2COOtBu; Propargyl-PEG5-tert-butyl ester; tert-Butyl 4,7,10,13,16-pentaoxanonadec-18-yn-1-oate; 1,1-Dimethylethyl 4,7,10,13,16-pentaoxanonadec-18-ynoate; 4,7,10,13,16-Pentaoxanonadec-18-ynoic acid, 1,1-dimethylethyl ester; 2-Methyl-2-propanyl 4,7,10,13,16-pentaoxanonadec-18-yn-1-oate; tert-butyl 4,7,10,13,16-pentaoxanonadec-18-ynoate
Purity ≥95%
Shelf Life 0-4°C for short term (days to weeks), or -20°C for long term (months).
IUPAC Name tert-butyl 3-[2-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]ethoxy]propanoate
Canonical SMILES CC(C)(C)OC(=O)CCOCCOCCOCCOCCOCC#C
InChI InChI=1S/C18H32O7/c1-5-7-20-9-11-22-13-15-24-16-14-23-12-10-21-8-6-17(19)25-18(2,3)4/h1H,6-16H2,2-4H3
InChI Key YPLMNICQRHSVNT-UHFFFAOYSA-N
Solubility Soluble in DMSO (10 mm)
Density 1.045±0.06 g/cm3 (Predicted)
Appearance Pale Yellow or Colorless Oily Liquid
Boiling Point 420.6±40.0 °C at 760 mmHg
Vapor Pressure 0.0±1.0 mmHg at 25°C
LogP 0.53
  • Product Specification
Storage Store at 2-8°C for short term (days to weeks) or -20°C for long term (months to years)

Computed Properties

XLogP3 0.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 18
Exact Mass 360.21480336 g/mol
Monoisotopic Mass 360.21480336 g/mol
Topological Polar Surface Area 72.4Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 367
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

Patents

Publication NumberTitlePriority Date
EP-3624854-A1 Protein-drug conjugates and their use in the treatment of cancers 2017-05-16
US-2020069815-A1 Protein-drug conjugates and their use in the treatment of cancers 2017-05-16
WO-2018210824-A1 Protein-drug conjugates and their use in the treatment of cancers 2017-05-16
EP-2448929-A1 Novel conjugates, preparation thereof, and therapeutic use thereof 2009-06-29
TW-201110986-A Novel conjugates, preparation thereof and therapeutic use thereof 2009-06-29
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