6-Azabicyclo(3.2.1)octane, 7-ethyl-1-(m-methoxyphenyl)-6-methyl-, hydrobromide

HCID 48711

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Basic information

CAS: 66968-14-7
Standard SMILES: CCC1[NH+](C)C2CCCC1(c1cccc(OC)c1)C2.[Br-]
InChIKey: NMGQCDDVTXNZIZ-UHFFFAOYSA-N
Molecular formula: C17H26BrNO
Average molar mass: 340.3 g/mol
Monoisotopic mass: 339.11978

Names & identifiers

Preferred name: 6-Azabicyclo(3.2.1)octane, 7-ethyl-1-(m-methoxyphenyl)-6-methyl-, hydrobromide
IUPAC: 7-ethyl-1-(3-methoxyphenyl)-6-methyl-6-azoniabicyclo[3.2.1]octane bromide

Names & synonyms

7-Ethyl-1-(m-methoxyphenyl)-6-methyl-6-azabicyclo(3.2.1)octane hydrobromide6-AZABICYCLO(3.2.1)OCTANE, 7-ETHYL-1-(m-METHOXYPHENYL)-6-METHYL-, HYDROBROMIDE66968-14-7RefChem:307198

Database identifiers

CAS: 66968-14-7
PubChem CID: 48711

Properties

Computed structural properties

Topological polar surface area: 13.7 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 3
Heavy atoms: 20
Formal charge: 0
Complexity: 318

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