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34846-64-5

34846-64-5 Structure

34846-64-5 Structure
IdentificationMore
[Name]

3-Cyanoquinoline
[CAS]

34846-64-5
[Synonyms]

3-CYANO-QUINOLINE
3-QUINOLINECARBONITRILE
QUINOLINE-3-CARBONITRILE
3-QUINOLINECARBONITRILE HPLC 98.0% YELLOW CRYSTALLINE POWDER
3-Quinolinecarbonitrile ,98%
[EINECS(EC#)]

252-248-6
[Molecular Formula]

C10H6N2
[MDL Number]

MFCD00006766
[Molecular Weight]

154.17
[MOL File]

34846-64-5.mol
Chemical PropertiesBack Directory
[Appearance]

white to light yellow crystal powder
[Melting point ]

108-110 °C (lit.)
[Boiling point ]

323.7±15.0 °C(Predicted)
[density ]

1.21±0.1 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,Room Temperature
[form ]

powder
[pka]

1.72±0.11(Predicted)
[color ]

White to off-white
[Detection Methods]

HPLC
[InChI]

InChI=1S/C10H6N2/c11-6-8-5-9-3-1-2-4-10(9)12-7-8/h1-5,7H
[InChIKey]

QZZYYBQGTSGDPP-UHFFFAOYSA-N
[SMILES]

N1C2C(=CC=CC=2)C=C(C#N)C=1
[CAS DataBase Reference]

34846-64-5(CAS DataBase Reference)
[NIST Chemistry Reference]

3-Quinolinecarbonitrile(34846-64-5)
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
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 .
S37/39:Wear suitable gloves and eye/face protection .
[WGK Germany ]

3
[HS Code ]

2933499090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

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

N,N-Dimethylformamide-->Bromine-->Benzene-->Pyridine-->POTASSIUM CYANIDE-->Copper(I) Cyanide-->Quinoline-->Carbon tetrabromide
[Preparation Products]

3-QuinolineMethanaMine, Monohydrochloride
Hazard InformationBack Directory
[Chemical Properties]

white to light yellow crystal powder
[Uses]

3-Quinolinecarbonitrile was used as a template for EGFR inhibitors.
Spectrum DetailBack Directory
[Spectrum Detail]

3-Cyanoquinoline(34846-64-5)1HNMR
3-Cyanoquinoline(34846-64-5)IR1
3-Cyanoquinoline(34846-64-5)IR2
3-Cyanoquinoline(34846-64-5)Raman
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

34846-64-5(sigmaaldrich)
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