Quinuclidine-4-carbaldehyde - CAS 55022-91-8

Catalog:	BB028887
Product Name:	Quinuclidine-4-carbaldehyde
CAS:	55022-91-8
Synonyms:	1-azabicyclo[2.2.2]octane-4-carboxaldehyde; 1-azabicyclo[2.2.2]octane-4-carbaldehyde

Technical Data

Patents

Computed Properties

IUPAC Name:	1-azabicyclo[2.2.2]octane-4-carbaldehyde
Description:	Quinuclidine-4-carbaldehyde (CAS# 55022-91-8 ) is a useful research chemical.
Molecular Weight:	139.19
Molecular Formula:	C8H13NO
Canonical SMILES:	C1CN2CCC1(CC2)C=O
InChI:	InChI=1S/C8H13NO/c10-7-8-1-4-9(5-2-8)6-3-8/h7H,1-6H2
InChI Key:	LJSJRQBQGMLHHU-UHFFFAOYSA-N
LogP:	0.60910

Publication Number	Title	Priority Date
WO-2021081272-A1	Progranulin modulators and methods of using the same	20191025
WO-2021030711-A1	Alkynyl quinazoline compounds	20190815
WO-2020252222-A1	Progranulin modulators and methods of using the same	20190612
WO-2020068867-A1	Quinazoline derivatives as tyrosine kinase inhibitor, compositions, methods of making them and their use	20180925
CN-113382986-A	Tyrosine kinase inhibitor compositions, methods of making and methods of using the same	20180925

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Complexity:	134
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	139.099714038
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	139.099714038
Rotatable Bond Count:	1
Topological Polar Surface Area:	20.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.2