2-Oxazoline, 2-(8,11-heptadecadienyl)-5-methyl-
Basic information
- CAS
64046-70-4- Standard SMILES
CCCCCC=CCC=CCCCCCCCC1=NCC(C)O1- InChIKey
BFGAOVWMEHPBAM-UHFFFAOYSA-N- Molecular formula
- C21H37NO
- Average molar mass
- 319.5 g/mol
- Monoisotopic mass
- 319.2875148
Names & identifiers
- Preferred name
- 2-Oxazoline, 2-(8,11-heptadecadienyl)-5-methyl-
- IUPAC
- 2-heptadeca-8,11-dienyl-5-methyl-4,5-dihydro-1,3-oxazole
Names & synonyms
2-Oxazoline, 2-(8,11-heptadecadienyl)-5-methyl-64046-70-4RefChem:10640262-(8,11-Heptadecadienyl)-5-methyl-2-oxazolineNSC 407788
Database identifiers
- CAS
64046-70-4- PubChem CID
- 101157
Properties
Computed structural properties
- XLogP
- 7
- Topological polar surface area
- 21.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 14
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 357
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Compound notes
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