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Butanoic acid,3-methyl-, 3-hexen-1-yl ester
CAS number：10032-11-8 molecular formula：C11H20O2
overview
Specs
| Chinese alias | - | ||
| English alias | Butanoicacid, 3-methyl-, 3-hexenyl ester (9CI); Isovaleric acid, 3-hexenyl ester (8CI); 3-Hexen-1-yl 3-methylbutanoate; 3-Hexenyl isovalerate | ||
| CAS number | 10032-11-8 | molecular formula | C11H20O2 |
| molecular weight | 184.2753 | Exact mass | - |
| PSA | - | logp | - |
numbering system
| CAS | 10032-11-8 |
| Wikidata | Q81991850 |
| PubChem CID | 37065 |
| DSSTox Substance ID | DTXSID9064920 |
| Metabolomics Workbench ID | 4237 |
| PubChem Reference Collection SID | 505567163 |
| MEP ID | _25Q1B41IV |
physicochemical properties
| XLogP3 | XLogP3-AA: 3.2 |
| Complexity | 159 |
| Exact Mass | 184.146329876 |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Molecular Weight | 184.27 |
| Monoisotopic Mass | 184.146329876 |
| Isotope Atom Count | 0 |
| Rotatable Bond Count | 7 |
| Hydrogen Bond Donor Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Topological Polar Surface Area | 26.3 Ų |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
Safety information
Regulatory Information：
New Zealand EPA Inventory of Chemical Status: Butanoic acid, 3-methyl-, 3-hexenyl ester: Does not have an individual approval but may be used under an appropriate group standard
Production methods and uses
purpose
EPA CPDat Chemical and Product Categories: cpdat
Related
upstream information
No upstream information yet
downstream information
No downstream information yet
MSDS
Found 0 shareMSDS
