1,3-Diethylurea - CAS 623-76-7
Catalog: |
BB031565 |
Product Name: |
1,3-Diethylurea |
CAS: |
623-76-7 |
Synonyms: |
1,3-diethylurea |
IUPAC Name: | 1,3-diethylurea |
Description: | 1,3-Diethylurea (CAS# 623-76-7) is a useful research chemical. |
Molecular Weight: | 116.16 |
Molecular Formula: | C5H12N2O |
Canonical SMILES: | CCNC(=O)NCC |
InChI: | InChI=1S/C5H12N2O/c1-3-6-5(8)7-4-2/h3-4H2,1-2H3,(H2,6,7,8) |
InChI Key: | ZWAVGZYKJNOTPX-UHFFFAOYSA-N |
Boiling Point: | 263 °C at 760 mmHg |
Melting Point: | 112-113 °C |
Purity: | 99 % |
Density: | 0.923 g/cm3 |
Appearance: | White solid |
MDL: | MFCD00009028 |
LogP: | 1.10720 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2015144600-A1 | Formulations and processes for finishing textiles | 20140324 |
WO-2015130424-A1 | Aqueous solution and methods for manufacture and use | 20140225 |
US-2015122485-A1 | Aqueous solution and method for use thereof | 20131105 |
US-2015122499-A1 | Aqueous solution and method for use thereof | 20131105 |
WO-2015069434-A1 | Aqueous solution and method for use thereof | 20131105 |
PMID | Publication Date | Title | Journal |
20689706 | 20100101 | Hydrogen-Bonded Networks Based on Cobalt(II), Nickel(II), and Zinc(II) Complexes of N,N'-Diethylurea | Bioinorganic chemistry and applications |
15025523 | 20040301 | Dimers of D-myo-inositol 1,4,5-trisphosphate: design, synthesis, and interaction with Ins(1,4,5)P3 receptors | Bioconjugate chemistry |
Complexity: | 64.8 |
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: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 116.094963011 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 41.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.1 |
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