5-Methylquinoxaline - CAS 13708-12-8

Catalog:	BB008508
Product Name:	5-Methylquinoxaline
CAS:	13708-12-8
Synonyms:	5-methylquinoxaline

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Computed Properties

IUPAC Name:	5-methylquinoxaline
Description:	5-Methylquinoxaline (CAS# 13708-12-8) is a useful research chemical compound.
Molecular Weight:	144.17
Molecular Formula:	C9H8N2
Canonical SMILES:	CC1=C2C(=CC=C1)N=CC=N2
InChI:	InChI=1S/C9H8N2/c1-7-3-2-4-8-9(7)11-6-5-10-8/h2-6H,1H3
InChI Key:	CQLOYHZZZCWHSG-UHFFFAOYSA-N
Boiling Point:	244.8 °C at 760 mmHg
Melting Point:	20-21 °C
Purity:	95 %
Density:	1.141 g/cm³
Appearance:	White powder
Storage:	Sealed in dry, Room Temperature
MDL:	MFCD00012335
LogP:	1.93820

Publication Number	Title	Priority Date
CN-112266364-A	Preparation method of tetrahydroquinoxaline compound	20201023
WO-2021174164-A1	Compounds and methods for modulating splicing	20200228
WO-2021101854-A1	Compounds and methods of preparing compounds s1p1 modulators	20191119
WO-2021083030-A1	Nitrogen-containing compound, electronic component and electronic apparatus	20191031
WO-2021071843-A1	Muscarinic acetylcholine m1 receptor antagonists	20191007

PMID	Publication Date	Title	Journal
22606274	20120101	Methylglyoxal mediates adipocyte proliferation by increasing phosphorylation of Akt1	PloS one
22216325	20110101	Increased renal methylglyoxal formation with down-regulation of PGC-1α-FBPase pathway in cystathionine γ-lyase knockout mice	PloS one

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Related Functional Groups

Quinoxalines

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[32601-86-8]
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[1628908-19-9]
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[7576-88-7]
6-Amino-2,3-dimethylquinoxaline
[55687-02-0]
6-Bromo-2-chloroquinoxaline
[50998-17-9]
6-Bromoquinoxaline

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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:	136
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	144.068748264
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	144.068748264
Rotatable Bond Count:	0
Topological Polar Surface Area:	25.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2