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Pyrimidine, 4,6-diiodo-

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Name

Pyrimidine, 4,6-diiodo-

EINECS N/A
CAS No. 19646-06-1 Density 2.765 g/cm3
PSA 25.78000 LogP 1.68580
Solubility N/A Melting Point N/A
Formula C4H2I2N2 Boiling Point 333.883 °C at 760 mmHg
Molecular Weight 331.882 Flash Point 155.727 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 19646-06-1 (4,6-DIIODOPYRIMIDINE) Hazard Symbols N/A
Synonyms

4,6-Diiodopyrimidine;

Article Data 12

Pyrimidine, 4,6-diiodo- Specification

The Pyrimidine, 4,6-diiodo- is an organic compound with the formula C4H2I2N2. The IUPAC name of this chemical is 4,6-diiodopyrimidine and the CAS registry number is 19646-06-1. In addition, the molecular weight is 331.881.

The other characteristics of Pyrimidine, 4,6-diiodo- can be summarized as: (1) ACD/LogP: 2.41; (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): 5; (6) ACD/BCF (pH 7.4): 5; (7) ACD/KOC (pH 5.5): 117; (8) ACD/KOC (pH 7.4): 117; (9) #H bond acceptors: 2; (10) #H bond donors: 0; (11) #Freely Rotating Bonds: 0; (12) Polar Surface Area: 25.78 Å2; (13) Index of Refraction: 1.737; (14) Molar Refractivity: 48.249 cm3; (15) Molar Volume: 120.027 cm3; (16) Surface Tension: 69.686 dyne/cm; (17) Density: 2.765 g/cm3; (18) Flash Point: 155.727 °C; (19) Enthalpy of Vaporization: 55.392 kJ/mol; (20) Boiling Point: 333.883 °C at 760 mmHg; (21) Vapour Pressure: 0 mmHg at 25 °C.

People can use the following data to convert to the molecule structure. 
1. SMILES:Ic1cc(I)ncn1
2. InChI:InChI=1/C4H2I2N2/c5-3-1-4(6)8-2-7-3/h1-2H
3. InChIKey:LBVUFZJYMWUZIW-UHFFFAOYAW
4. Std. InChI:InChI=1S/C4H2I2N2/c5-3-1-4(6)8-2-7-3/h1-2H 
5. Std. InChIKey:LBVUFZJYMWUZIW-UHFFFAOYSA-N

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