5-Methylquinoxaline

CAT: 0127-OR80731-01Size: 25 gDry Ice: NoHazardous: No

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CAT#:0127-OR80731-01Size:25 g

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CAS Number

13708-12-8

MDL Number

MFCD00012335

Purity

98%

Smiles

C1=CC=C2C(=C1C)N=CC=N2

Chemical Information

5-Methylquinoxaline

5-methylquinoxaline is a quinoxaline derivative in which the quinoxaline (1,4-naphthyridine) skeleton is substituted at C-5 with a methyl group.

CAS Number	13708-12-8
PubChem CID	61670
IUPAC Name	5-methylquinoxaline
Molecular Formula	C9H8N2
Molecular Weight	144.17
XLogP	2
Topological Polar Surface Area	25.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Heavy Atom Count	11
Formal Charge	0
Complexity	136

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

InChIKey

CQLOYHZZZCWHSG-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 13708-12-8

CID: 61670

Formula: C9H8N2

MW: 144.17

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	144.17
XLogP3	2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	144.068748264
Monoisotopic Mass	144.068748264
Topological Polar Surface Area	25.8 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	136
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR1038389-01	5-Bromo-8-methylquinoxaline
OR1047262-01	5-Chloro-8-methylquinoxaline
OR01556	3-Methylquinoxaline-5-carboxylic acid
OR964038	2-Methylquinoxaline
OR0653-01	6-Methylquinoxaline
OR909336-01	6-Chloro-7-methylquinoxaline
OR300638-01	2-Hydroxy-3-methylquinoxaline
OR303925-01	2-Chloro-3-methylquinoxaline
OR903996-01	2-Chloro-7-methylquinoxaline
OR1052995-01	2-Chloro-6-methylquinoxaline

Catalog	Name
sc-254854	5-Methylquinoxaline
HWA93495-01	7-Bromo-5-methylquinoxaline
TBB27642-01	5-Bromo-7-methylquinoxaline
HY-W015672-01	2-Methylquinoxaline
ITB29955-01	2-Methylquinoxaline-5-carboxylic acid
UAA85369-01	5,7-Dichloro-6-methylquinoxaline
sc-278547	6-Methylquinoxaline
DAA14926-01	2-Methoxy-3-methylquinoxaline
MBA92099-01	2-Ethyl-3-methylquinoxaline
423615-01	3-Acetyl-2-methylquinoxaline