3-Methyl-2-hexenoic acid (3:1 mixture of E and Z isomers) (CAS 27960-21-0) — formula C7H12O2, molecular weight 128.17; category organic chemicals.
| CAS Number | 27960-21-0 |
|---|---|
| Molecular Formula | C7H12O2 |
| Molecular Weight | 128.17 |
| LogP | 2.2 |
| Category | Organic Chemicals |
3-Methyl-2-hexenoic acid (3:1 mixture of E and Z isomers) is a carbon-based organic compound with CAS registry number 27960-21-0 and molecular formula C7H12O2 (molecular weight 128.17), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 27960-21-0
Its molecular formula C7H12O2 comprises 7 C, 12 H, 2 O atoms.
Also known as: 3-Methyl-2-hexenoic acid (3:1 mixture of E and Z isomers) · 3-甲基-2-己烯酸（E 和 Z 异构体的 3:1 混合物）
Category: organic chemicals
The CAS registry number of 3-Methyl-2-hexenoic acid (3:1 mixture of E and Z isomers) is 27960-21-0.
Molecular formula C7H12O2, molecular weight 128.17.
It is also registered under: 3-Methyl-2-hexenoic acid (3:1 mixture of E and Z isomers), 3-甲基-2-己烯酸（E 和 Z 异构体的 3:1 混合物）.
Category: Organic Chemicals.
Independent reference data for 3-Methyl-2-hexenoic acid (3:1 mixture of E and Z isomers) (CAS 27960-21-0), compiled from public chemistry databases.
| CAS Registry Number | 27960-21-0 |
|---|---|
| PubChem CID | 6443739 |
| Molecular formula | C7H12O2 |
| IUPAC name | (E)-3-methylhex-2-enoic acid |
| UNII (FDA) | Q98FU4WJ65 |
| Molecular Weight | 128.17 |
|---|---|
| XLogP3 | 2.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 3 |
| Exact Mass | 128.083729621 |
| Monoisotopic Mass | 128.083729621 |
| Topological Polar Surface Area | 37.3 |
| Heavy Atom Count | 9 |
27960-21-0; 3-Methyl-2-hexenoic acid; (2E)-3-methylhex-2-enoic acid; trans-3-Methyl-2-hexenoic acid; (2E)-3-methyl-2-Hexenoic acid; Q98FU4WJ65; CHEBI:144845; DTXSID701020850; 2-Hexenoic acid, 3-methyl-, (E)-; RefChem:898796; DTXCID001505245; 696-310-4; (E)-3-methylhex-2-enoic acid; (e)-3-methyl-2-hexenoic acid; 3-Methyl-2E-hexenoic acid; MFCD02258698
3-Methyl-2-hexenoic acid (3:1 mixture of E and Z isomers) · CAS 27960-21-0 · C7H12O2. UNII Q98FU4WJ65.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.