(4S,5S)-2,2-Dimethyl-5-pentyl-1,3-dioxolane-4-carboxaldehyde - CAS 88557-32-8
Catalog: |
BB066867 |
Product Name: |
(4S,5S)-2,2-Dimethyl-5-pentyl-1,3-dioxolane-4-carboxaldehyde |
CAS: |
88557-32-8 |
Synonyms: |
(4S,5S)-2,2-Dimethyl-5-pentyl-1,3-dioxolane-4-carboxaldehyde |
IUPAC Name: | (4S,5S)-2,2-dimethyl-5-pentyl-1,3-dioxolane-4-carbaldehyde |
Description: | (4S,5S)-2,2-Dimethyl-5-pentyl-1,3-dioxolane-4-carboxaldehyde is a useful reagent in stereoselective synthesis. |
Molecular Weight: | 200.27 |
Molecular Formula: | C11H20O3 |
Canonical SMILES: | CCCCCC1C(OC(O1)(C)C)C=O |
InChI: | InChI=1S/C11H20O3/c1-4-5-6-7-9-10(8-12)14-11(2,3)13-9/h8-10H,4-7H2,1-3H3/t9-,10+/m0/s1 |
InChI Key: | YSLKOEAOCUWVEB-VHSXEESVSA-N |
References: | Patil, P,. et al. RSC Advances, 5, 49189 (2015). |
Complexity: | 189 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 2 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 200.1412445 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 200.1412445 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 35.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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