1,4-Pentanediol - CAS 626-95-9
Catalog: |
BB031734 |
Product Name: |
1,4-Pentanediol |
CAS: |
626-95-9 |
Synonyms: |
pentane-1,4-diol |
IUPAC Name: | pentane-1,4-diol |
Description: | 1,4-Pentanediol (CAS# 626-95-9) is a useful synthetic intermediate. It was used in the preparation of poly(ortho ester). 1,4-Pentanediol on dehydration in water at 573K yields five-membered ether, 2-methyltetrahydrofuran. |
Molecular Weight: | 104.15 |
Molecular Formula: | C5H12O2 |
Canonical SMILES: | CC(CCCO)O |
InChI: | InChI=1S/C5H12O2/c1-5(7)3-2-4-6/h5-7H,2-4H2,1H3 |
InChI Key: | GLOBUAZSRIOKLN-UHFFFAOYSA-N |
Boiling Point: | 72-73 °C0.03 mmHg (lit.) |
Purity: | 95 % |
Density: | 0.986 g/cm3 |
Appearance: | Colorless liquid |
MDL: | MFCD00004560 |
LogP: | 0.13970 |
Publication Number | Title | Priority Date |
CN-113249081-A | Polyurethane adhesive film and preparation method and application thereof | 20210715 |
CN-113249081-B | Polyurethane adhesive film and preparation method and application thereof | 20210715 |
CN-113293454-A | Tensile deformation yarn for anti-wrinkle fabric and preparation method thereof | 20210528 |
CN-113321796-A | High-transparency high-heat-resistance copolyester resin and preparation method thereof | 20210526 |
CN-113332979-A | Preparation method and application of copper catalyst prepared by polymerization reaction | 20210520 |
PMID | Publication Date | Title | Journal |
21849077 | 20110817 | An alternative route for the synthesis of silicon nanowires via porous anodic alumina masks | Nanoscale research letters |
21699704 | 20110623 | Experimental H-type bovine spongiform encephalopathy characterized by plaques and glial- and stellate-type prion protein deposits | Veterinary research |
20218617 | 20100401 | Solvation of the amphiphilic diol molecule in aliphatic alcohol-water and fluorinated alcohol-water solutions | The journal of physical chemistry. B |
17497020 | 20060101 | Metal-Based Antibacterial and Antifungal Agents: Synthesis, Characterization, and In Vitro Biological Evaluation of Co(II), Cu(II), Ni(II), and Zn(II) Complexes With Amino Acid-Derived Compounds | Bioinorganic chemistry and applications |
15355075 | 20040915 | Micellar cobaltporphyrin nanorods in alcohols | Journal of the American Chemical Society |
Complexity: | 37.1 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 104.083729621 |
Formal Charge: | 0 |
Heavy Atom Count: | 7 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 104.083729621 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 40.5 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0 |
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