Allyloxycarbonyl succinimidyl ester
Product Information
Molecular Formula
C8H9NO5
Molecular Weight
199.16
Description
Allyloxycarbonyl succinimidyl ester can be used as a building block for the preparation of glycopeptide scaffolds and a reagent in the synthesis of various functional cyclic carbonate monomers from 2-amino-1,3-propane diols.
Synonyms
Allyl N-Succinimidyl Carbonate; AmbotzRL-1108; alloc-N-hydroxysuccinimide; N-(Allyloxycarbonyloxy)succinimide; allyloxycarbonyl-N-hydroxysuccinimide; Alloc-OSu; AllylN-succinimidylcarbonate; carbonic acid allyl ester 2,5-dioxo-pyrrolidin-1-yl ester; Allyl (2,5-dioxopyrrolidin-1-yl) carbonate; CTK8B0450; DTXSID10472673; ZINC2583986; ANW-19957; Aloc-OSu
IUPAC Name
(2,5-dioxopyrrolidin-1-yl) prop-2-enyl carbonate
SMILES
C=CCOC(=O)ON1C(=O)CCC1=O
InChI
InChI=1S/C8H9NO5/c1-2-5-13-8(12)14-9-6(10)3-4-7(9)11/h2H,1,3-5H2
InChI Key
OIXALTPBNZNFLJ-UHFFFAOYSA-N
Boiling Point
269.5±33.0 °C (Predicted)
Melting Point
21 °C
Flash Point
117 °C
Purity
95 % (HPLC)
Density
1.287 g/mL at 25 °C
Appearance
White solid
Storage
2-8 °C
Refractive Index
1.48
LogP
0.32750
Safety Information
Hazards
H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
Causes skin irritation.
H319:
Causes serious eye irritation.
Precautionary Statement
P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word
Warning
Computed Properties
XLogP3
0.3
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
5
Rotatable Bond Count
5
Exact Mass
199.04807239 g/mol
Monoisotopic Mass
199.04807239 g/mol
Topological Polar Surface Area
72.9Ų
Heavy Atom Count
14
Formal Charge
0
Complexity
270
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
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| CN-111628220-A | Electrolyte additive, electrolyte containing additive and lithium ion battery | 2020-06-18 |
