Basic information
- CAS
328250-28-8- Standard SMILES
CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@@H](C[N+](C)(C)C)OC(=O)CCCCCCC/C=C\CCCCCCCC.[Cl-]- InChIKey
KSXTUUUQYQYKCR-HEXDFCBFSA-M- Molecular formula
- C42H80ClNO4
- Average molar mass
- 698.5 g/mol
- Monoisotopic mass
- 697.5775877
Names & identifiers
- Preferred name
- Dotap chloride, (R)-
- IUPAC
- [(2R)-2,3-bis[[(Z)-octadec-9-enoyl]oxy]propyl]-trimethylazanium chloride
- English name
- 1,2-Dioleoyl-3(R)-trimethylammoniumpropane (chloride)
- Molecular weight
- 698.54
Names & synonyms
Dotap chloride, (R)-(2R)-Dotap chlorideW8RN9Z2473UNII-W8RN9Z2473328250-28-81-Propanaminium, N,N,N-trimethyl-2,3-bis(((9Z)-1-oxo-9-octadecen-1-yl)oxy)-, chloride (1:1), (2R)-(R)-N,N,N-Trimethyl-2,3-bis(oleoyloxy)propan-1-aminium chloride(R)-DOTAP chlorideSCHEMBL28356972PD197877Q27292469R-DOTAP(DOTAP R-isomer )
Show more names
1,2-Dioleoyl-3(R)-trimethylammoniumpropane (chloride)1-Propanaminium, N,N,N-trimethyl-2,3-bis[[(9Z)-1-oxo-9-octadecen-1-yl]oxy]-, chloride (1:1), (2R)-
Database identifiers
- CAS
328250-28-8- PubChem CID
- 11629023
- UNII
- W8RN9Z2473
Properties
Computed structural properties
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 37
- Heavy atoms
- 48
- Formal charge
- 0
- Complexity
- 754
Physicochemical properties
- solubility
- 3 mg/mlEthanol: · DMF: 3 mg/mlEthanol: 16 mg/ml
- FDA UNII
- 8 RN9Z2473 · W8RN9Z2473
Chemistry & industry
Applications
Uses1,2-Dioleoyl-3(R)-trimethylammoniumpropane chloride is a biochemical reagent.
Suppliers1 total
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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