(S)-(+)-1,2-Propanediol - CAS 4254-15-3
Catalog: |
BB025160 |
Product Name: |
(S)-(+)-1,2-Propanediol |
CAS: |
4254-15-3 |
Synonyms: |
(+)-1,2-Propanediol; (2S)-1,2-Propanediol; (+)-(S)-1,2-Propanediol; (S)-(+)-Propane-1,2-diol; (S)-(+)-Propylene Glycol; (S)-2-Hydroxy-1-propanol; (S)-2-Hydroxypropanol; (S)-Propane-1,2-diol; (S)-Propylene Glycol; 3-Deoxy-sn-glycerol; L-(+)-Propanediol; L-(+)-Propylene Glycol; L-1,2-Propanediol |
Related CAS: | 57-55-6 (rac-isomer)
|
IUPAC Name: | (2S)-propane-1,2-diol |
Description: | It has been widely used as a solvent, extractant and preservative in a variety of parenteral and nonparenteral pharmaceutical formulations. |
Molecular Weight: | 76.09 |
Molecular Formula: | C3H8O2 |
Canonical SMILES: | CC(CO)O |
InChI: | InChI=1S/C3H8O2/c1-3(5)2-4/h3-5H,2H2,1H3/t3-/m0/s1 |
InChI Key: | DNIAPMSPPWPWGF-VKHMYHEASA-N |
Boiling Point: | 184.8±8.0°C at 760 mmHg |
Melting Point: | -60 °C |
Flash Point: | 103 °C(217.4 °F) |
Purity: | ≥95% |
Density: | 1.036 g/mL |
Solubility: | Soluble in Chloroform (Sparingly), Methanol (Slightly), Water (Slightly) |
Appearance: | Colorless liquid |
Storage: | Store at RT |
MDL: | MFCD00004539 |
LogP: | -0.64050 |
Refractive Index: | 1.43 |
GHS Hazard Statement: | H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] |
Precautionary Statement: | P264, P280, P305+P351+P338, and P337+P313 |
Signal Word: | Warning |
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PMID | Publication Date | Title | Journal |
22221669 | 20120301 | Redesign of coenzyme B(12) dependent diol dehydratase to be resistant to the mechanism-based inactivation by glycerol and act on longer chain 1,2-diols | The FEBS journal |
21384208 | 20110701 | Gallates of isoorientin and (2S)-1,2-propanediol glucoside from the leaves of Schoepfia jasminodora | Journal of natural medicines |
21392547 | 20110410 | Selective oxidation and reduction reactions with cofactor regeneration mediated by galactitol-, lactate-, and formate dehydrogenases immobilized on magnetic nanoparticles | Journal of biotechnology |
19202108 | 20090201 | Analysis of the promoter activities of the genes encoding three quinoprotein alcohol dehydrogenases in Pseudomonas putida HK5 | Microbiology (Reading, England) |
18071270 | 20071201 | Relative and absolute configuration of antitumor agent SW-163D | Bioscience, biotechnology, and biochemistry |
Complexity: | 20.9 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 76.052429494 |
Formal Charge: | 0 |
Heavy Atom Count: | 5 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 76.052429494 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 40.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.9 |
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