ChemicalBook--->CAS DataBase List--->25475-67-6

25475-67-6

25475-67-6 Structure

25475-67-6 Structure
IdentificationMore
[Name]

ISOQUINOLIN-3-AMINE
[CAS]

25475-67-6
[Synonyms]

3-AMINOISOQUINOLINE
IFLAB-BB F2108-0097
ISOQUINOLIN-3-AMINE
Isoquinolin-3-amine, 95+%
3-Isoquinolinamine
[Molecular Formula]

C9H8N2
[MDL Number]

MFCD00102190
[Molecular Weight]

144.17
[MOL File]

25475-67-6.mol
Chemical PropertiesBack Directory
[Melting point ]

154-156°C
[Boiling point ]

331.2±15.0 °C(Predicted)
[density ]

1.210±0.06 g/cm3(Predicted)
[storage temp. ]

Keep in dark place,Inert atmosphere,Room temperature
[form ]

solid
[pka]

5.05(at 20℃)
[color ]

Yellow/green
[InChI]

InChI=1S/C9H8N2/c10-9-5-7-3-1-2-4-8(7)6-11-9/h1-6H,(H2,10,11)
[InChIKey]

VYCKDIRCVDCQAE-UHFFFAOYSA-N
[SMILES]

C1C2=C(C=CC=C2)C=C(N)N=1
[CAS DataBase Reference]

25475-67-6(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S24/25:Avoid contact with skin and eyes .
[WGK Germany ]

3
[Hazard Note ]

Irritant
[HS Code ]

2933491090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Ethanol-->Methanol-->Diethyl ether-->Sulfuric acid-->Sodium carbonate-->Bromine-->Potassium hydroxide-->Ammonium hydroxide-->Isoquinoline-3-carboxylic acid
[Preparation Products]

3-Bromoisoquinoline-->2-Phenylimidazo(2,1-a)isoquinoline-->3-(1-Piperazinyl)isoquinoline
Hazard InformationBack Directory
[Definition]

Isoquinolin-3-amines bearing an alkyl group or hydrogen atom in position 4 easily underwent Buchwald-Hartwig coupling reactions with various substituted aryl halide[1].
[References]

[1] Jozsef A Balog. “Novel fluorescent isoquinoline derivatives obtained via Buchwald-Hartwig coupling of isoquinolin-3-amines.” Arkivoc 2012 1 (2012): 109–119.
Spectrum DetailBack Directory
[Spectrum Detail]

Isoquinolin-3-amine(25475-67-6)1HNMR
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

isoquinolin-3-amine(25475-67-6)
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