Sulfuric acid, monoethyl ester, compd. with (9Z,9'Z)-N,N'-[(ethylimino)di-2,1-ethanediyl]bis[9-octadecenamide] (1:1)
Basic information
- CAS
67846-12-2- Standard SMILES
CCCCCCCC/C=C\CCCCCCCC(=O)NCCN(CC)CCNC(=O)CCCCCCC/C=C\CCCCCCCC.CCOS(=O)(=O)O- InChIKey
ZYVBAZSLDBUEAZ-JDVCJPALSA-N- Molecular formula
- C44H87N3O6S
- Average molar mass
- 786.2 g/mol
- Monoisotopic mass
- 785.63155868
Names & identifiers
- Preferred name
- Sulfuric acid, monoethyl ester, compd. with (9Z,9'Z)-N,N'-[(ethylimino)di-2,1-ethanediyl]bis[9-octadecenamide] (1:1)
- IUPAC
- ethyl hydrogen sulfate;(Z)-N-[2-[ethyl-[2-[[(Z)-octadec-9-enoyl]amino]ethyl]amino]ethyl]octadec-9-enamide
Names & synonyms
EINECS 267-357-467846-12-2RefChem:186673Ethylbis(2-(oleoylamino)ethyl)ammonium ethyl sulphateZYVBAZSLDBUEAZ-JDVCJPALSA-N
Database identifiers
- CAS
67846-12-2- PubChem CID
- 6437152
- EC Number
- 267-357-4
Properties
Computed structural properties
- Topological polar surface area
- 133 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 39
- Heavy atoms
- 54
- Formal charge
- 0
- Complexity
- 780
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationSulfuric acid, monoethyl ester, compd. with (9Z,9'Z)-N,N'-[(ethylimino)di-2,1-ethanediyl]bis[9-octadecenamide] (1:1): INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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