10-Hydroxy-2-decanone - CAS 35295-48-8
Catalog: |
BB061060 |
Product Name: |
10-Hydroxy-2-decanone |
CAS: |
35295-48-8 |
Synonyms: |
10-hydroxydecan-2-one; 10-Hydroxy-2-decanone; 9-Oxodecan-1-ol |
IUPAC Name: | 10-hydroxydecan-2-one |
Description: | 10-Hydroxy-2-decanone is an intermediate used in the synthesis of Monooxoisodecyl Phthalate (M547915), which is a derivative of Monoisodecyl Phthalate (M547905) which activates mouse and human Peroxisome Proliferator-Activated Receptors (PPARs). |
Molecular Weight: | 172.26 |
Molecular Formula: | C10H20O2 |
Canonical SMILES: | CC(=O)CCCCCCCCO |
InChI: | InChI=1S/C10H20O2/c1-10(12)8-6-4-2-3-5-7-9-11/h11H,2-9H2,1H3 |
InChI Key: | YVJYDCIOSPAUPO-UHFFFAOYSA-N |
Solubility: | Chloroform; Dichloromethane; Ethyl Acetate; Methanol |
Appearance: | White Solid |
References: | Bisset, K. M., et al. Neurochem. Internatio., 59 (5), 706 (2011); Bility, M. T., et al. Toxico. Sci., 82 (1), 170 (2004). |
Complexity: | 110 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 172.146329876 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 172.146329876 |
Rotatable Bond Count: | 8 |
Topological Polar Surface Area: | 37.3Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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