4-(Aminomethyl)tetrahydro-2H-pyran-4-ol - CAS 783303-73-1

Catalog:	BB036153
Product Name:	4-(Aminomethyl)tetrahydro-2H-pyran-4-ol
CAS:	783303-73-1
Synonyms:	4-(aminomethyl)-4-oxanol; 4-(aminomethyl)oxan-4-ol

Technical Data

Patents

Computed Properties

IUPAC Name:	4-(aminomethyl)oxan-4-ol
Description:	4-(Aminomethyl)tetrahydro-2H-pyran-4-ol (CAS# 783303-73-1) is a useful research chemical.
Molecular Weight:	131.17
Molecular Formula:	C6H13NO2
Canonical SMILES:	C1COCCC1(CN)O
InChI:	InChI=1S/C6H13NO2/c7-5-6(8)1-3-9-4-2-6/h8H,1-5,7H2
InChI Key:	CGPIFQOTBHKPNM-UHFFFAOYSA-N
Boiling Point:	258.69 °C at 760 mmHg
Purity:	95 %
Density:	1.115 g/cm³
Appearance:	Solid
LogP:	0.18690

Publication Number	Title	Priority Date
US-2020392154-A1	Pyridine carbamates and their use as glun2b receptor modulators	20190614
WO-2020249799-A1	Pyridine carbamates and their use as glun2b receptor modulators	20190614
CN-111808056-A	Dopamine D2Receptor selective agonists and their use in the treatment of disease	20190410
US-2020055874-A1	INHIBITORS OF KEAP1-Nrf2 PROTEIN-PROTEIN INTERACTION	20180820
WO-2020041169-A2	Inhibitors of keap1-nrf2 protein-protein interaction	20180820

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Complexity:	89.1
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	131.094628657
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	131.094628657
Rotatable Bond Count:	1
Topological Polar Surface Area:	55.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-1.2