Basic information
- CAS
328250-29-9- Standard SMILES
CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@@H](C[N+](C)(C)C)OC(=O)CCCCCCC/C=C\CCCCCCCC- InChIKey
KWVJHCQQUFDPLU-KNEFWTSXSA-N- Molecular formula
- C42H80NO4+
- Average molar mass
- 663.1 g/mol
- Monoisotopic mass
- 662.60873503
Names & identifiers
- Preferred name
- R-Dotap
- IUPAC
- [(2R)-2,3-bis[[(Z)-octadec-9-enoyl]oxy]propyl]-trimethylazanium
Names & synonyms
R-Dotap(2R)-DotapDotap, (R)-XER76TF9RN328250-29-9328250-28-81-Propanaminium, N,N,N-trimethyl-2,3-bis(((9Z)-1-oxo-9-octadecen-1-yl)oxy)-, (2R)-UNII-XER76TF9RNorb1785916SCHEMBL29614909R-DOTAP(DOTAP R-isomer )?PD197878
Database identifiers
- CAS
328250-29-9- PubChem CID
- 11629024
- UNII
- XER76TF9RN
Properties
Computed structural properties
- XLogP
- 15.1
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 37
- Heavy atoms
- 47
- Formal charge
- 1
- Complexity
- 754
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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