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CAS No.: | 31776-83-7 | ||||||||||||||
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Name: | 2-CHLORO-6-(4-FLUOROPHENYL)NICOTINONITRILE | ||||||||||||||
Article Data: | 3 | ||||||||||||||
Molecular Structure: | |||||||||||||||
Formula: | C12H6 Cl F N2 | ||||||||||||||
Molecular Weight: | 232.644 | ||||||||||||||
Synonyms: | Nicotinonitrile,2-chloro-6-(p-fluorophenyl)- (8CI);2-Chloro-6-(4-fluorophenyl)pyridin-3-nitrile | ||||||||||||||
Density: | 1.37g/cm3 | ||||||||||||||
Melting Point: | 173-176°C | ||||||||||||||
Boiling Point: | 373.3°Cat760mmHg | ||||||||||||||
Flash Point: | 179.5°C | ||||||||||||||
Hazard Symbols: | |||||||||||||||
Risk Codes: | 20/21/22-36/37/38 | ||||||||||||||
Safety: |
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Molecular structure of 2-Chloro-6-(4-fluorophenyl)nicotinonitrile (CAS NO.31776-83-7) is:
Product Name: 2-Chloro-6-(4-fluorophenyl)nicotinonitrile
CAS Registry Number: 31776-83-7
IUPAC Name: 2-Chloro-6-(4-fluorophenyl)pyridine-3-carbonitrile
Molecular Weight: 232.640843 [g/mol]
Molecular Formula: C12H6ClFN2
XLogP3-AA: 3.3
H-Bond Donor: 0
H-Bond Acceptor: 3
Melting Point: 173-176 °C
Index of Refraction: 1.612
Molar Refractivity: 58.76 cm3
Molar Volume: 168.9 cm3
Surface Tension: 57.4 dyne/cm
Density: 1.37 g/cm3
Flash Point: 179.5 °C
Enthalpy of Vaporization: 62.05 kJ/mol
Boiling Point: 373.3 °C at 760 mmHg
Vapour Pressure: 9.07E-06 mmHg at 25 °C
Canonical SMILES: C1=CC(=CC=C1C2=NC(=C(C=C2)C#N)Cl)F
InChI: InChI=1S/C12H6ClFN2/c13-12-9(7-15)3-6-11(16-12)8-1-4-10(14)5-2-8/h1-6H
InChIKey: VJYNNRPTVYPCCS-UHFFFAOYSA-N
Safty information about 2-Chloro-6-(4-fluorophenyl)nicotinonitrile (CAS NO.31776-83-7) is:
Hazard Codes: Xi
Risk Statements 20/21/22-36/37/38
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 26-36/37/39
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.
RIDADR: 3439
Hazard Note: Irritant
HazardClass: 6.1
PackingGroup: III
2-Chloro-6-(4-fluorophenyl)nicotinonitrile , its cas register number is 31776-83-7. It also can be called 3-Pyridinecarbonitrile,2-chloro-6-(4-fluorophenyl)- .