1. Primary Information
| English name: | Batyl alcohol |
| CAS No.: | 544-62-7 |
| Molecular formula: | C21H44O3 |
| Molecular weight: | 344.6 g/mol |
| SMILES: | CCCCCCCCCCCCCCCCCCOCC(CO)O |
| Structural class: | |
| Other identifiers: |
1-O-octadecylglycerol 3-octadecyloxy-propane-1,2-diol batyl alcohol batyl alcohol, (DL)-isomer batyl alcohol, (R)-isomer |
2. Suppliers & Pricing
| Supplier | Pack size | Purity | Price (CNY) | Storage conditions | Lead time | Notes |
| Kehua Intelligence | 100mg | GC≥98% | 320 | 2-8℃ | in stock | - |
3. Structures
3.1 2D structure
3.2 3D structure
Coming soon
4. International Nomenclature & Identifiers
4.1 IUPAC Name
3-octadecoxypropane-1,2-diol
4.2 InChI
InChI=1S/C21H44O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24-20-21(23)19-22/h21-23H,2-20H2,1H3
4.3 InChIKey
OGBUMNBNEWYMNJ-UHFFFAOYSA-N
4.4 Canonical SMILES
CCCCCCCCCCCCCCCCCCOCC(CO)O
4.5 Isomeric SMILES
-
4.6 SDF file
Coming soon
5. Spectroscopic data
5.1 13C nuclear magnetic resonance (13C NMR)
5.2 1H nuclear magnetic resonance (1H NMR)
5.3 Mass spectrometry (MS)
Coming soon
5.4 Infrared spectroscopy (IR)
Coming soon
5.5 Ultraviolet/visible spectroscopy (UV/Vis)
Coming soon
-- No 3D model data available --
