4-Pyridinecarbonitrile,3-iodo- supplier

Name
3-IODOPYRIDINE-4-CARBONITRILE
EINECS
CAS No. 10386-28-4
Article Data4
CAS DataBase
Density 2.04 g/cm³
Solubility
Melting Point 119-122oC
Formula C₆H₃IN₂
Boiling Point 303.1 °C at 760 mmHg
Molecular Weight 230.00
Flash Point 137.1 °C
Transport Information
Appearance
Safety UN3439
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Isonicotinonitrile,3-iodo- (7CI,8CI);3-Iodoisonicotinonitrile;3-Iodopyridine-4-carbonitrile;4-Cyano-3-Iodopyridine;
PSA 36.68000
LogP 1.55788

4-Pyridinecarbonitrile,3-iodo- Specification

The 4-Pyridinecarbonitrile,3-iodo-, with the CAS registry number 10386-28-4, is also known as 3-Iodoisonicotinonitrile. It belongs to the product category of Pyridines. This chemical's molecular formula is C₆H₃IN₂ and molecular weight is 230.00. What's more, its systematic name is 3-Iodopyridine-4-carbonitrile. If it is used and stored as specification, it will not decompose. It must be sealed up in a cool and dry place.

Physical properties of 4-Pyridinecarbonitrile,3-iodo- are: (1)ACD/LogP: 1.55; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 6; (6)ACD/BCF (pH 7.4): 6; (7)ACD/KOC (pH 5.5): 118; (8)ACD/KOC (pH 7.4): 118; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 36.68 Å²; (13)Index of Refraction: 1.67; (14)Molar Refractivity: 42.041 cm³; (15)Molar Volume: 112.61 cm³; (16)Polarizability: 16.667×10^-24 cm³; (17)Surface Tension: 67.285 dyne/cm; (18)Density: 2.043 g/cm³; (19)Flash Point: 137.14 °C; (20)Enthalpy of Vaporization: 54.342 kJ/mol; (21)Boiling Point: 303.149 °C at 760 mmHg; (22)Vapour Pressure: 0.001 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: N#Cc1ccncc1I
(2)InChI: InChI=1/C6H3IN2/c7-6-4-9-2-1-5(6)3-8/h1-2,4H
(3)InChIKey: KMFIQUYSWTUCGD-UHFFFAOYAS

Product Name

3-IODOPYRIDINE-4-CARBONITRILE

4-Pyridinecarbonitrile,3-iodo- Specification

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