2-Norbornanol, 3-(benzylmethylaminomethyl)-
Basic information
- CAS
74111-27-6- Standard SMILES
CN(Cc1ccccc1)CC1C2CCC(C2)C1O- InChIKey
PHMYEAYOKNYDGR-UHFFFAOYSA-N- Molecular formula
- C16H23NO
- Average molar mass
- 245.36 g/mol
- Monoisotopic mass
- 245.17796436
Names & identifiers
- Preferred name
- 2-Norbornanol, 3-(benzylmethylaminomethyl)-
- IUPAC
- 3-[[benzyl(methyl)amino]methyl]bicyclo[2.2.1]heptan-2-ol
- English name
- 3-[Benzyl(methyl)aminomethyl]-2-norbornanol
- Molecular formula
- C16H23NO
- Molecular weight
- 245.36
Names & synonyms
2-Norbornanol, 3-(benzylmethylaminomethyl)-RefChem:106394974111-27-63-(N-Benzyl-N-methylaminomethyl)-2-norbornanolMLS0026947663-[[benzyl(methyl)amino]methyl]bicyclo[2.2.1]heptan-2-ol3-{[benzyl(methyl)amino]methyl}bicyclo[2.2.1]heptan-2-olBicyclo(2.2.1)heptan-2-ol, 3-((methyl(phenylmethyl)amino)methyl)-Bicyclo[2.2.1]heptan-2-ol, 3-[[methyl(phenylmethyl)amino]methyl]-3-(N-Methyl-N-benzylaminomethyl)norborneolNSC 87603BRN 2839720
Show more names
3-[Benzyl(methyl)aminomethyl]-2-norbornanol3-{[methyl(phenylmethyl)amino]methyl}-bicyclo[2.2.1]heptan-2-ol
2-Norbornanol, 3-[(benzylmethylamino)methyl]-NSC87603CHEMBL1872156DTXSID90995552HMS3087A21NSC-87603WLN: L55 ATJ CQ D1N1&1RSMR001560686
Database identifiers
- CAS
74111-27-6- PubChem CID
- 98187
- DTXSID
DTXSID90995552- ChEMBL
CHEMBL1872156- Nikkaji
- J64.713F
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 274
Physicochemical properties
- Boiling point
- 355 · 355.0±15.0 °C(Predicted)
- Density
- 1.094 · 1.094±0.06 g/cm3(Predicted)
- pka
- 15.17 · 15.17±0.40(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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