5-Hydroxynicotinaldehyde - CAS 1060804-48-9

Catalog:	BB001777
Product Name:	5-Hydroxynicotinaldehyde
CAS:	1060804-48-9
Synonyms:	5-hydroxy-3-pyridinecarboxaldehyde; 5-hydroxypyridine-3-carbaldehyde

Technical Data

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Computed Properties

IUPAC Name:	5-hydroxypyridine-3-carbaldehyde
Description:	5-Hydroxynicotinaldehyde (CAS# 1060804-48-9) is a useful research chemical.
Molecular Weight:	123.11
Molecular Formula:	C6H5NO2
Canonical SMILES:	C1=C(C=NC=C1O)C=O
InChI:	InChI=1S/C6H5NO2/c8-4-5-1-6(9)3-7-2-5/h1-4,9H
InChI Key:	LMCXPBAARDWGRD-UHFFFAOYSA-N
Storage:	Inert atmosphere, 2-8 °C
LogP:	0.59970

Publication Number	Title	Priority Date
DE-102019210986-A1	Increasing the stability of agents for treating keratin material	20190724
WO-2021013419-A1	Increasing the stability of agents for treating keratin material	20190724
EP-3157909-A1	Lmp7 inhibitors	20140620
US-10654843-B2	LMP7 inhibitors	20140620
US-2018208589-A1	Lmp7 inhibitors	20140620

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Related Functional Groups

Carbonyl Compounds

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[51493-02-8]
N-Methyl-N-propylcarbamoyl Chloride
[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[956439-56-8]
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	105
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	123.032028402
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	123.032028402
Rotatable Bond Count:	1
Topological Polar Surface Area:	50.2 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0