Basic information
- CAS
23257-62-7- Standard SMILES
CCCCN(CC(O)COc1ccccc1)CC(O)COc1ccccc1- InChIKey
ZDRJSLHBNGHXNK-UHFFFAOYSA-N- Molecular formula
- C22H31NO4
- Average molar mass
- 373.5 g/mol
- Monoisotopic mass
- 373.22530847
Names & identifiers
- Preferred name
- N,N-Bis(3-phenoxy-2-hydroxypropyl)butyl amine
- IUPAC
- 1-[butyl-(2-hydroxy-3-phenoxypropyl)amino]-3-phenoxypropan-2-ol
Names & synonyms
23257-62-7N,N-Bis(3-phenoxy-2-hydroxypropyl)butyl amineSCHEMBL6931910DTXSID90945951N,N-Bis(3-phenoxy-2-hydroxy-propyl)-butylamine1,1'-(Butylazanediyl)bis(3-phenoxypropan-2-ol)
Database identifiers
- CAS
23257-62-7- PubChem CID
- 141017
- DTXSID
DTXSID90945951
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 62.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 13
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 326
Experimental & physicochemical properties
SpringerMaterials PropertiesBoiling point
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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