2-Phenylquinoxaline

HCID 78725
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Basic information

CAS
5021-43-2
Standard SMILES
c1ccc(-c2cnc3ccccc3n2)cc1
InChIKey
QWNCDHYYJATYOG-UHFFFAOYSA-N
Molecular formula
C14H10N2
Average molar mass
206.24 g/mol
Monoisotopic mass
206.08439832

Names & identifiers

Preferred name
2-Phenylquinoxaline
IUPAC
2-phenylquinoxaline
English name
2-Phenylquinoxaline
Molecular formula
C14H10N2
Molecular weight
206.24

Names & synonyms

2-PhenylquinoxalineQuinoxaline, 2-phenyl-DTXSID50198244NSC 52086RefChem:265411DTXCID80120735QWNCDHYYJATYOG-UHFFFAOYSA-N5021-43-2phenylquinoxalineQuinoxaline, phenyl-NSC520862-Phenyl-quinoxaline
Show more names
AG-1152
SCHEMBL87505CHEMBL69695SCHEMBL578186SCHEMBL713066SCHEMBL713067SCHEMBL1450354SCHEMBL5885621SCHEMBL29371290

Database identifiers

CAS
5021-43-2
PubChem CID
78725
DTXSID
DTXSID50198244
ChEMBL
CHEMBL69695
Nikkaji
J101.691A

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
25.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
16

Experimental & physicochemical properties

LogP3.48

Physicochemical properties

Melting point
132 · 132-133 °C
Boiling point
362.9 · 362.9±27.0 °C(Predicted)
Density
1.176 · 1.176±0.06 g/cm3(Predicted)
pka
0.57 · 0.57±0.30(Predicted)

Chemistry & industry

Upstream & downstream products

Downstream products

Suppliers9 total

奥思恩（北京）科技有限公司18201687790 18201687790 · [email protected]
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
吉林中科研伸科技有限公司18143011203 · [email protected]
成都安普生医药科技有限公司13568817957 · [email protected]
烟台盛凯伦化学科技有限公司13356901049 · [email protected]

Related reactions

2 records
New reaction record

Compound notes

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