Basic information
- Standard SMILES
Nc1cnc2cc(Cl)c(Cl)cc2n1- InChIKey
IEUXCSKRIXCLGL-UHFFFAOYSA-N- Molecular formula
- C8H5Cl2N3
- Average molar mass
- 214.05 g/mol
- Monoisotopic mass
- 212.9860526
Names & identifiers
- Preferred name
- 6,7-Dichloroquinoxalin-2-amine
- IUPAC
- 6,7-dichloroquinoxalin-2-amine
- English name
- 6,7-DICHLORO-QUINOXALIN-2-YLAMINE
- Molecular formula
- C8H5Cl2N3
- Molecular weight
- 214.05
Names & synonyms
6,7-Dichloroquinoxalin-2-amine76002-68-16,7-DICHLORO-QUINOXALIN-2-YLAMINESCHEMBL11372767DTXSID00555328IEUXCSKRIXCLGL-UHFFFAOYSA-N2-amino-6,7-dichloro-quinoxalineDA-19099CS-05278882-Quinoxalinamine, 6,7-dichloro-
Database identifiers
- CAS
76002-68-1- PubChem CID
- 14067518
- DTXSID
DTXSID00555328
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 51.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 190
Physicochemical properties
- Melting point
- 220 · 220-222 °C(Solv: ethanol (64-17-5))
- Boiling point
- 369.5 · 369.5±37.0 °C(Predicted)
- Density
- 1.571 · 1.571±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 2 · 2.00±0.48(Predicted)
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers6 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
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上海书亚医药科技有限公司400-685-9117 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 19370895928 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Related reactions
3 records
Linked notes
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