Basic information
- CAS
102416-96-6- Standard SMILES
CCOC(=O)Nc1cccc(OCC(O)CNC(C)C)c1- InChIKey
JEQULDRSHKFDNC-UHFFFAOYSA-N- Molecular formula
- C15H24N2O4
- Average molar mass
- 296.36 g/mol
- Monoisotopic mass
- 296.17360725
Names & identifiers
- Preferred name
- Carbamic acid, (3-(2-hydroxy-3-((1-methylethyl)amino)propoxy)phenyl)-, ethyl ester
- IUPAC
- ethyl N-[3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]carbamate
Names & synonyms
102416-96-6Carbamic acid, (3-(2-hydroxy-3-((1-methylethyl)amino)propoxy)phenyl)-, ethyl esterDTXSID40907488Ethyl hydrogen (3-{2-hydroxy-3-[(propan-2-yl)amino]propoxy}phenyl)carbonimidate
Database identifiers
- CAS
102416-96-6- PubChem CID
- 54975
- DTXSID
DTXSID40907488- Nikkaji
- J455.128A
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 79.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 299
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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