Tetramethylurea - CAS 632-22-4
Catalog: |
BB032058 |
Product Name: |
Tetramethylurea |
CAS: |
632-22-4 |
Synonyms: |
1,1,3,3-tetramethylurea |
IUPAC Name: | 1,1,3,3-tetramethylurea |
Description: | Tetramethylurea (CAS# 632-22-4) is a useful isotopically labeled research compound. |
Molecular Weight: | 116.16 |
Molecular Formula: | C5H12N2O |
Canonical SMILES: | CN(C)C(=O)N(C)C |
InChI: | InChI=1S/C5H12N2O/c1-6(2)5(8)7(3)4/h1-4H3 |
InChI Key: | AVQQQNCBBIEMEU-UHFFFAOYSA-N |
Boiling Point: | 174-178 °C |
Melting Point: | -1.2 °C |
Flash Point: | ABOUT 75 °C |
Density: | 0.9879 g/cm3 |
Solubility: | Miscible with water, Petroleum ether, All common solvents |
Appearance: | Liquid |
MDL: | MFCD00008319 |
LogP: | 0.22960 |
Vapor Pressure: | 13.9 mm Hg at 71 °C |
GHS Hazard Statement: | H302 (97.87%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P201, P202, P264, P270, P281, P301+P312, P308+P313, P330, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
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PMID | Publication Date | Title | Journal |
22582830 | 20120606 | Long-time correlations and hydrophobe-modified hydrogen-bonding dynamics in hydrophobic hydration | Journal of the American Chemical Society |
22142224 | 20120118 | Ligand exchange on colloidal CdSe nanocrystals using thermally labile tert-butylthiol for improved photocurrent in nanocrystal films | Journal of the American Chemical Society |
22322801 | 20120101 | Reevaluation of donor number using titration calorimetry | Analytical sciences : the international journal of the Japan Society for Analytical Chemistry |
21950866 | 20110921 | Proton transport in a binary biomimetic solution revealed by molecular dynamics simulation | The Journal of chemical physics |
21287251 | 20110701 | Denaturation mechanism of BSA by urea derivatives: evidence for hydrogen-bonding mode from fluorescence tools | Journal of fluorescence |
Complexity: | 78.4 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 116.094963011 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 116.094963011 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 23.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.2 |
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