2-Quinoxalinecarbaldehyde - CAS 1593-08-4

Catalog:	BB011520
Product Name:	2-Quinoxalinecarbaldehyde
CAS:	1593-08-4
Synonyms:	2-quinoxalinecarboxaldehyde; quinoxaline-2-carbaldehyde

Technical Data

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Computed Properties

IUPAC Name:	quinoxaline-2-carbaldehyde
Description:	A 2-substituted quinoxaline derivative used in the preparation of stabilized hemiacetals with a wide range of cosmetic uses.
Molecular Weight:	158.16
Molecular Formula:	C9H6N2O
Canonical SMILES:	C1=CC=C2C(=C1)N=CC(=N2)C=O
InChI:	InChI=1S/C9H6N2O/c12-6-7-5-10-8-3-1-2-4-9(8)11-7/h1-6H
InChI Key:	UJEHWLFUEQHEEZ-UHFFFAOYSA-N
Boiling Point:	319.8 °C at 760 mmHg
Density:	1.299 g/cm³
Appearance:	Solid
LogP:	1.44230

Publication Number	Title	Priority Date
WO-2021024943-A1	Scaffold material for cell culture and cell culture container	20190802
WO-2020264261-A1	Bidentate diazinylamido complexes as catalysts for olefin polymerization	20190628
WO-2020241675-A1	Resin film formed by scaffold material for cell culture and container for cell culture	20190528
WO-2020230884-A1	Cell culturing scaffold material and cell culturing container	20190515
WO-2020230885-A1	Cell culturing scaffolding material and cell culturing vessel	20190515

PMID	Publication Date	Title	Journal
21588112	20100731	Tetra-ethyl-ammonium tricarbonyl-chlorido(quinoxaline-2-carboxyl-ato-κN,O)rhenate(I)	Acta crystallographica. Section E, Structure reports online
19966442	20091201	Two novel bis-azomethines derived from quinoxaline-2-carbaldehyde	Acta crystallographica. Section C, Crystal structure communications
21583657	20090725	N-[(E)-Quinoxalin-2-ylmethyl-idene]-1H-indazol-5-amine	Acta crystallographica. Section E, Structure reports online
21582020	20090131	N,N'-Bis[(E)-quinoxalin-2-ylmethyl-idene]-ethane-1,2-diamine	Acta crystallographica. Section E, Structure reports online

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GHS Hazard Statement:	H315 (97.62%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362
Signal Word:	Warning

Complexity:	172
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	158.048012819
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	158.048012819
Rotatable Bond Count:	1
Topological Polar Surface Area:	42.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.1