2-Amino-1-phenyloctan-1-ol
Basic information
- CAS
7467-55-2- Standard SMILES
CCCCCCC(N)C(O)c1ccccc1- InChIKey
QJTHXZQVXLUYAM-UHFFFAOYSA-N- Molecular formula
- C14H23NO
- Average molar mass
- 221.34 g/mol
- Monoisotopic mass
- 221.17796436
Names & identifiers
- Preferred name
- 2-Amino-1-phenyloctan-1-ol
- IUPAC
- 2-amino-1-phenyloctan-1-ol
Names & synonyms
2-amino-1-phenyloctan-1-ol7467-55-2NSC4009732-amino-1-phenyl-octan-1-olSCHEMBL9207797DTXSID60275494QJTHXZQVXLUYAM-UHFFFAOYSA-NNSC-400973(1RS,2RS)-2-amino-1-phenyloctan-1-olDS-008690
Database identifiers
- CAS
7467-55-2- PubChem CID
- 46268
- DTXSID
DTXSID60275494
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 46.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 166
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Related reactions
2 records
Compound notes
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