Basic information
- CAS
5804-62-6- Standard SMILES
CCCCCCCCOc1ccc(N)cc1CO- InChIKey
OBBIUTKBYBFQRJ-UHFFFAOYSA-N- Molecular formula
- C15H25NO2
- Average molar mass
- 251.36 g/mol
- Monoisotopic mass
- 251.18852904
Names & identifiers
- Preferred name
- Benzyl alcohol, 5-amino-2-(octyloxy)-
- IUPAC
- (5-amino-2-octoxyphenyl)methanol
Names & synonyms
5804-62-6BENZYL ALCOHOL, 5-AMINO-2-(OCTYLOXY)-5-Amino-2-(octyloxy)benzyl alcoholM & B 5912BRN 2730321DTXSID60206763RefChem:328557DTXCID90129254(5-amino-2-octoxyphenyl)methanolorb1986396AKOS030555769[5-AMINO-2-(OCTYLOXY)PHENYL]METHANOL
Show more names
T30414
Database identifiers
- CAS
5804-62-6- PubChem CID
- 22052
- DTXSID
DTXSID60206763
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 55.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 199
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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