2-Acetylquinoxaline

CAT: 0127-OR965860-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR965860-01Size:250 mg

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CAS Number

25594-62-1

MDL Number

MFCD07808559

Purity

99%

Smiles

CC(=O)c1cnc2ccccc2n1

Chemical Information

1-(Quinoxalin-2-yl)ethan-1-one

CAS Number	25594-62-1
PubChem CID	11105814
IUPAC Name	1-quinoxalin-2-ylethanone
Molecular Formula	C10H8N2O
Molecular Weight	172.18
XLogP	1.3
Topological Polar Surface Area	42.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Heavy Atom Count	13
Formal Charge	0
Complexity	205

SMILES

CC(=O)C1=NC2=CC=CC=C2N=C1

InChI

InChI=1S/C10H8N2O/c1-7(13)10-6-11-8-4-2-3-5-9(8)12-10/h2-6H,1H3

InChIKey

SWGILLQQUULMJB-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 25594-62-1

CID: 11105814

Formula: C10H8N2O

MW: 172.18

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	172.18
XLogP3	1.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	172.063662883
Monoisotopic Mass	172.063662883
Topological Polar Surface Area	42.9 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	205
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
OR470156-01	3-Acetylquinoline
OR965852-01	6-Acetylquinoline
OR1059592-01	Methyl 5-acetylquinoline-3-carboxylate
OR1056024-01	Methyl 6-acetylquinoline-3-carboxylate
OR1061878-01	7-Acetylquinoline-3-carboxylic acid
OR1042385-01	3-Acetylquinoline-4-carboxylic acid
OR1056180-01	6-Acetylquinoline-3-carboxylic acid
OR1062006-01	5-Acetylquinoline-3-carboxylic acid
OR1060127-01	Methyl 7-acetylquinoline-3-carboxylate
PC1003049-01	2,2,2-Trifluoroethyl 2,2,2-trichloroacetate

Catalog	Name
sc-265343	2-Acetylquinoxaline
H 038-005	2'- , 2''-, 2''', 2'''', 2''''', 2''''''- Hexadeoxy- 2'-, 2'', 2''', 2'''', 2''''', 2''''''- hexafluoro- cyclic hexaadenosine monophosphate (2',2'',2''',2'''',2''''',2''''''-Hexa-F-c-hexadAMP / cFA6), sodium salt
TRC-T790200-50MG	2,2,2-Trifluoroethyl 2,5-Bis(2,2,2-trifluoroethoxy)benzoate
MBS6106553-01	2,2,2-Trifluoroethyl 2-Hydroxy-5-(2,2,2-trifluoroethoxy)benzoate
D443501	Diethyl-2,2,2,2',2',2'-d6-amine HCl
290342-01	2,2,2-Trifluoroethyl 2,5-bis (2,2,2-trifluoroethoxy) benzoate
TRC-T790195-25G	2-[2-(2,2,2-Trifluoroethoxy)phenoxy]-ethanol
sc-474673	2-[2- (2,2,2-Trifluoroethoxy) phenoxy]-ethanol
290343-01	2,2,2-Trifluoroethyl 2-hydroxy-5- (2,2,2-trifluoroethoxy) benzoate
D3554-34-01	2’,2’-Difluoro-2’-deoxyuridine (2’-Deoxy-2’,2’-difluorouridine)