Basic information
- CAS
94108-74-4- Standard SMILES
CCCCCCCCCCOCCOCCOP(=O)(O)OCCOCCOCCCCCCCCCC.CCCCCCCCCCOCCOCCOP(=O)(O)OCCOCCOCCCCCCCCCC.NCCCCCCCCCCCCN- InChIKey
QRNJFSUMKAVHJB-UHFFFAOYSA-N- Molecular formula
- C68H146N2O16P2
- Average molar mass
- 1,309.8 g/mol
- Monoisotopic mass
- 1,309.01476057
Names & identifiers
- Preferred name
- Bis(2-(2-(decyloxy)ethoxy)ethyl) hydrogen phosphate, compound with dodecane-1,12-diamine (2:1)
- IUPAC
- bis(bis[2-(2-decoxyethoxy)ethyl] hydrogen phosphate);dodecane-1,12-diamine
Names & synonyms
EINECS 302-412-994108-74-4Bis(2-(2-(decyloxy)ethoxy)ethyl) hydrogen phosphate, compound with dodecane-1,12-diamine (2:1)DTXSID20240587Bis[2-[2-(decyloxy)ethoxy]ethyl] hydrogen phosphate, compound with dodecane-1,12-diamine (2:1)RefChem:120044DTXCID50163078302-412-9NS00064279Bis{2-[2-(decyloxy)ethoxy]ethyl} hydrogen phosphate--dodecane-1,12-diamine (2/1)
Database identifiers
- CAS
94108-74-4- PubChem CID
- 44147366
- DTXSID
DTXSID20240587- EC Number
- 302-412-9
Properties
Computed structural properties
- Topological polar surface area
- 237 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 18
- Rotatable bonds
- 75
- Heavy atoms
- 88
- Formal charge
- 0
- Complexity
- 525
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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