Basic information
- CAS
70615-19-9- Standard SMILES
CCCCCCCCCCCCCOCCCNCCCN.CN(CCCCCCCCCCCC=O)CC(=O)O.CN(CCCCCCCCCCCC=O)CC(=O)O- InChIKey
YXIXXSSORYDAMF-UHFFFAOYSA-N- Molecular formula
- C49H100N4O7
- Average molar mass
- 857.3 g/mol
- Monoisotopic mass
- 856.75920154
Names & identifiers
- Preferred name
- bis(2-[methyl(12-oxododecyl)amino]acetic acid);N'-(3-tridecoxypropyl)propane-1,3-diamine
- IUPAC
- bis(2-[methyl(12-oxododecyl)amino]acetic acid);N'-(3-tridecoxypropyl)propane-1,3-diamine
Database identifiers
- CAS
70615-19-9- PubChem CID
- 112433
Properties
Computed structural properties
- Topological polar surface area
- 163 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 47
- Heavy atoms
- 60
- Formal charge
- 0
- Complexity
- 420
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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