Basic information
- CAS
346612-95-1- Standard SMILES
CN(Cc1ccccc1)Cc1c(O)ccc2ccccc12- InChIKey
OGPNOYCZRBAADM-UHFFFAOYSA-N- Molecular formula
- C19H19NO
- Average molar mass
- 277.4 g/mol
- Monoisotopic mass
- 277.14666423
Names & identifiers
- Preferred name
- 1-{[Benzyl(methyl)amino]methyl}-2-naphthol
- IUPAC
- 1-[[benzyl(methyl)amino]methyl]naphthalen-2-ol
Names & synonyms
1-[[benzyl(methyl)amino]methyl]naphthalen-2-ol346612-95-11-{[benzyl(methyl)amino]methyl}-2-naphthol1-{[benzyl(methyl)amino]methyl}naphthalen-2-olTimTec1_004677Oprea1_425209MLS001001147CHEMBL1409368OGPNOYCZRBAADM-UHFFFAOYSA-NDTXSID901324955HMS1547E13HMS2842A15
Show more names
AKOS001040448EBC-612319SMR000496356ST512639581-([Benzyl(methyl)amino]methyl)-2-naphthol #Naphthalen-2-ol, 1-(benzyl)methylaminomethyl-AB00084968-01Z44092769
Database identifiers
- CAS
346612-95-1- PubChem CID
- 577695
- DTXSID
DTXSID901324955- ChEMBL
CHEMBL1409368- Nikkaji
- J3.691.396G
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 313
Experimental & physicochemical properties
Solubility26.6 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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