6-Aminoquinoxaline

C₈H₇N₃CAS 6298-37-9145.16 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₈H₇N₃
Molar mass: 145.16 g/mol
Exact mass: 145.0640 Da
logP: 1.21Crippen estimate
Polar surface area: 51.8 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 0

Hazards

Warning

H302 Harmful if swallowed93.5% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers

Aggregated from 46 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P270, P280, P301+P317, P302+P352, P305+P351+P338, P321, P330, P332+P317, P337+P317, P362+P364, P501

Identifiers

CAS number

6298-37-9

SMILES

C1=CC2=NC=CN=C2C=C1N

InChIKey

MSGRFBKVMUKEGZ-UHFFFAOYSA-N

InChI

InChI=1S/C8H7N3/c9-6-1-2-7-8(5-6)11-4-3-10-7/h1-5H,9H2

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names

6-Quinoxalinamine

Work with 6-Aminoquinoxaline

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

6-Aminoquinoline580-15-457 % similar 7-Aminoquinoline580-19-857 % similar 2,1,3-Benzothiadiazol-5-amine874-37-352 % similar 6-Bromoquinoxaline50998-17-948 % similar 6-Chloroquinoxaline5448-43-148 % similar 6-Methylquinoxaline6344-72-548 % similar Benzothiazol-5-amine1123-93-947 % similar 1,3-Benzoxazol-6-amine177492-52-347 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1,7-Naphthyridin-8-amine17965-82-1 2-(1H-Imidazol-2-yl)-pyridine18653-75-3 Diiminoisoindole3468-11-9 3-(1H-Pyrazol-3-yl)pyridine45887-08-9 3-(1H-Imidazol-5-yl)pyridine51746-85-1 1,3-Diiminoisoindoline57500-34-2 2-(1H-Pyrazol-3-yl)pyridine75415-03-1

Elsewhere

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