2-Heptadecyl-5-methyl-4,5-dihydro-1,3-oxazole
Basic information
- CAS
7507-09-7- Standard SMILES
CCCCCCCCCCCCCCCCCC1=NCC(C)O1- InChIKey
RHSNPEVUYIMVQJ-UHFFFAOYSA-N- Molecular formula
- C21H41NO
- Average molar mass
- 323.6 g/mol
- Monoisotopic mass
- 323.31881493
Names & identifiers
- Preferred name
- 2-Heptadecyl-5-methyl-4,5-dihydro-1,3-oxazole
- IUPAC
- 2-heptadecyl-5-methyl-4,5-dihydro-1,3-oxazole
Names & synonyms
7507-09-72-heptadecyl-5-methyl-4,5-dihydro-1,3-oxazoleNSC407913DTXSID003248792-Oxazoline, 2-heptadecyl-5-methylNSC-4079132-heptadecyl-5-methyl-4,5-dihydrooxazole
Database identifiers
- CAS
7507-09-7- PubChem CID
- 348541
- DTXSID
DTXSID00324879
Properties
Computed structural properties
- XLogP
- 8.6
- Topological polar surface area
- 21.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 16
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 288
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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