Phenol, 3-(6-ethyl-7-methyl-6-azabicyclo(3.2.1)oct-1-yl)-, hydrochloride, endo-(+-)-

HCID 3045767

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Basic information

CAS: 61098-74-6
Standard SMILES: CCN1C2CCCC(c3cccc(O)c3)(C2)C1C.Cl
InChIKey: BTOLQIWHXLMBRK-UHFFFAOYSA-N
Molecular formula: C16H24ClNO
Average molar mass: 281.82 g/mol
Monoisotopic mass: 281.1546421

Names & identifiers

Preferred name: Phenol, 3-(6-ethyl-7-methyl-6-azabicyclo(3.2.1)oct-1-yl)-, hydrochloride, endo-(+-)-
IUPAC: 3-(6-ethyl-7-methyl-6-azabicyclo[3.2.1]octan-1-yl)phenol;hydrochloride

Names & synonyms

endo-(+-)-3-(6-Ethyl-7-methyl-6-azabicyclo(3.2.1)oct-1-yl)phenol hydrochloride61098-74-6Phenol, 3-(6-ethyl-7-methyl-6-azabicyclo(3.2.1)oct-1-yl)-, hydrochloride, endo-(+-)-RefChem:369152CHEMBL3251458SCHEMBL11864464DTXSID809766133-(6-Ethyl-7-methyl-6-azabicyclo[3.2.1]octan-1-yl)phenol--hydrogen chloride (1/1)

Database identifiers

CAS: 61098-74-6
PubChem CID: 3045767
DTXSID: DTXSID80976613
ChEMBL: CHEMBL3251458

Properties

Computed structural properties

Topological polar surface area: 23.5 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 2
Rotatable bonds: 2
Heavy atoms: 19
Formal charge: 0
Complexity: 305

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