Glycoluril - CAS 496-46-8
Catalog: |
BB026761 |
Product Name: |
Glycoluril |
CAS: |
496-46-8 |
Synonyms: |
Glycoluril;Acetyleneurea;Glyoxalbiuret;Glyoxaldiurene |
IUPAC Name: | 1,3,3a,4,6,6a-hexahydroimidazo[4,5-d]imidazole-2,5-dione |
Description: | Glycoluril (CAS# 496-46-8) is used as a reagent in the synthesis of acyclic cucurbit[n]uril molecular containers which can enhance the solubility and bioactivity of poorly soluble pharmaceuticals. Also used as a reagent in the synthesis of cucurbit[7]uril containers for targeted delivery of oxaliplatin to cancer cells. |
Molecular Weight: | 142.116 |
Molecular Formula: | C4H6N4O2 |
Canonical SMILES: | C12C(NC(=O)N1)NC(=O)N2 |
InChI: | InChI=1S/C4H6N4O2/c9-3-5-1-2(7-3)8-4(10)6-1/h1-2H,(H2,5,7,9)(H2,6,8,10) |
InChI Key: | VPVSTMAPERLKKM-UHFFFAOYSA-N |
Boiling Point: | 861.6°Cat760mmHg |
Melting Point: | >300 °C(lit.) |
Flash Point: | 421.8°C |
Purity: | 0.99 |
Density: | 1.42g/cm3 |
Appearance: | Whitetoyellowishcrystallinepowder |
Storage: | Storeinatightlyclosedcontainer.Storeinacool,dry,well-ventilatedareaawayfromincompatiblesubstances. |
LogP: | -0.4206 |
Refractive Index: | 1.514 |
Stability: | Stableundernormaltemperaturesandpressures. |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P301+P317, P330, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113249016-A | TMMGU system powder coating catalyst composition capable of providing texture effect and powder coating | 20210622 |
CN-113209168-A | Traditional Chinese medicine composition for dispelling wind and activating blood circulation and application thereof in treating or preventing peripheral neuropathy caused by taxus drugs | 20210428 |
CN-113072557-A | Method for synthesizing hydroxycucurbituril by ozone oxidation | 20210402 |
CN-112979883-A | High-temperature-resistant salt-resistant polymer, and preparation method and application thereof | 20210317 |
CN-113150770-A | Molecular assembly fluorescent probe and preparation method and application thereof | 20210224 |
PMID | Publication Date | Title | Journal |
22814511 | 20120904 | Hydration of isocyanates in an expandable, self-assembled capsule | Chemical communications (Cambridge, England) |
22765643 | 20120725 | Encapsulation of ion pairs in extended, self-assembled structures | Journal of the American Chemical Society |
22048687 | 20120101 | Reversibly expanded encapsulation complexes | Topics in current chemistry |
22002600 | 20111209 | Self-assembled capsules of unprecedented shapes | Angewandte Chemie (International ed. in English) |
22009688 | 20111201 | Combinatorial optimization of a molecular glass photoresist system for electron beam lithography | Advanced materials (Deerfield Beach, Fla.) |
Complexity: | 165 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 142.04907545 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 4 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 142.04907545 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 82.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -1.6 |
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