Basic information
- CAS
73698-75-6- Standard SMILES
CC[NH+](CC)CCOCCOCCOCCOCCOC(=O)c1ccc(N)cc1.[Cl-]- InChIKey
UPRPCUSNRFCFEA-UHFFFAOYSA-N- Molecular formula
- C21H37ClN2O6
- Average molar mass
- 449 g/mol
- Monoisotopic mass
- 448.2340146
Names & identifiers
- Preferred name
- 15-Ethyl-3,6,9,12-tetraoxa-15-azaheptadecan-1-yl 4-aminobenzoate--hydrogen chloride (1/1)
- IUPAC
- 2-[2-[2-[2-[2-(4-aminobenzoyl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl-diethylazanium chloride
Names & synonyms
73698-75-6DTXSID5099456115-Ethyl-3,6,9,12-tetraoxa-15-azaheptadecan-1-yl 4-aminobenzoate--hydrogen chloride (1/1)RefChem:1057534DTXCID601421594Benzoic acid, p-amino-, 2-(2-(2-(2-(2-(diethylamino)ethoxy)ethoxy)ethoxy)ethoxy)ethyl ester, hydrochloride
Database identifiers
- CAS
73698-75-6- PubChem CID
- 52244
Properties
Computed structural properties
- Topological polar surface area
- 93.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 19
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 387
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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