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7a-(2,6-Difluoro-3-pyridinyl)-hexahydro-1h-pyrrolizine hydrochloride

HCID 18934779
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
Cl.Fc1ccc(C23CCCN2CCC3)c(F)n1
InChIKey
MWUPKEXFJWEPSR-UHFFFAOYSA-N
Molecular formula
C12H15ClF2N2
Average molar mass
260.71 g/mol
Monoisotopic mass
260.0891825

Names & identifiers

Preferred name
7a-(2,6-Difluoro-3-pyridinyl)-hexahydro-1h-pyrrolizine hydrochloride
IUPAC
8-(2,6-difluoro-3-pyridinyl)-1,2,3,5,6,7-hexahydropyrrolizine;hydrochloride

Names & synonyms

SCHEMBL6999888MWUPKEXFJWEPSR-UHFFFAOYSA-N7a-(2,6-difluoro-3-pyridinyl)-hexahydro-1h-pyrrolizine hydrochloride

Database identifiers

PubChem CID
18934779

Properties

Computed structural properties

Topological polar surface area
16.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
1
Heavy atoms
17
Formal charge
0
Complexity
262

Related reactions

1 records
New reaction record
HRID 3294 reaction equation
HRID 3294As productuspto-grants-1998_03

Compound notes

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