3-Quinuclidyl phenylglyoxylate

HCID 19095987
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Basic information

Standard SMILES
O=C(OC1CN2CCC1CC2)C(=O)c1ccccc1
InChIKey
LODCMCANOJSMKV-UHFFFAOYSA-N
Molecular formula
C15H17NO3
Average molar mass
259.3 g/mol

Names & identifiers

Preferred name
3-Quinuclidyl phenylglyoxylate
IUPAC
1-azabicyclo[2.2.2]octan-3-yl 2-oxo-2-phenylacetate

Names & synonyms

3-quinuclidyl phenylglyoxylateSCHEMBL1234896LODCMCANOJSMKV-UHFFFAOYSA-N

Database identifiers

PubChem CID
19095987

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
46.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
19

Related reactions

1 records
New reaction record

Compound notes

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