trans-2-(6-Methylheptanol-1-YL)3-hydroxymethyl-4butanolide
4-(hydroxymethyl)-3-(1-hydroxy-6-methylheptyl)oxolan-2-one
Also Known As: MHHMB|2-3-hydroxymethyl-4-butanolide|2- -3-hydroxymethyl-4-butanolide|J2.441.695J|2-(6'-Methylheptanoyl)-3-hydroxymethyl-4-butanolide|2-(6'-Methylheptanol-1'-yl)-3-hydroxymethyl-4-butanolide|2-(1'-hydroxy-6-methylheptyl)-3-(hydroxymethyl)-butanolide|4-(hydroxymethyl)-3-(1-hydroxy-6-methylheptyl)oxolan-2-one|3-(1-HYDROXY-6-METHYLHEPTYL)-4-(HYDROXYMETHYL)OXOLAN-2-ONE|TRANS-2-(6-METHYLHEPTANOL-1-YL)3-HYDROXYMETHYL-4BUTANOLIDE|2(3H)-Furanone, dihydro-4-(hydroxymethyl)-3-(1-hydroxy-6-methylheptyl)-|3-(Hydroxymethyl)-4-(1-hydroxy-6-methylheptyl)tetrahydrofuran-5-one
| Molecular Formula | C13H24O4 |
|---|---|
| Molecular Weight | 244.16747 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 244.16747 |
| Monoisotopic Mass | 244.16747 |
| Heavy Atoms | 17 |
| Complexity | 240.0 |
Chemical Identifiers
| CAS Number | 84666-71-7 |
|---|---|
| SMILES | CC(C)CCCCC(C1C(COC1=O)CO)O |
| InChIKey | XRKZVXDFKCVICZ-UHFFFAOYSA-N |
Product Overview
trans-2-(6-Methylheptanol-1-YL)3-hydroxymethyl-4butanolide (CAS 84666-71-7), with molecular formula C13H24O4 and molecular weight 244.16747 g/mol. IUPAC: 4-(hydroxymethyl)-3-(1-hydroxy-6-methylheptyl)oxolan-2-one.