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312612-61-6

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Basic Information
CAS No.: 312612-61-6
Name: 9-IODO-10-PHENYLPHENANTHRENE
Article Data: 5
Molecular Structure:
Molecular Structure of 312612-61-6 (9-IODO-10-PHENYLPHENANTHRENE)
Formula: C20H13I
Molecular Weight: 380.228
Synonyms: 9-Iodo-10-phenylphenanthrene;
Density: 1.552 g/cm3
Boiling Point: 475.101 °C at 760 mmHg
Flash Point: 214.668 °C
PSA: 0.00000
LogP: 6.26460
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Specification

The 9-Iodo-10-phenylphenanthrene with its cas register number is 312612-61-6. It also can be called as Phenanthrene,9-iodo-10-phenyl- and the Systematic name about this chemical is 9-iodo-10-phenylphenanthrene.

Physical properties about 9-Iodo-10-phenylphenanthrene are: (1)ACD/LogP: 7.61; (2)# of Rule of 5 Violations: 1; (3)#Freely Rotating Bonds: 1; (4)Index of Refraction: 1.746; (5)Molar Refractivity: 99.437 cm3; (6)Molar Volume: 245.023 cm3; (7)Polarizability: 39.42x10-24cm3; (8)Surface Tension: 53.902 dyne/cm; (9)Enthalpy of Vaporization: 71.036 kJ/mol.

You can still convert the following datas into molecular structure:
(1)SMILES: Ic2c(c3c(c1c2cccc1)cccc3)c4ccccc4
(2)InChI: InChI=1/C20H13I/c21-20-18-13-7-5-11-16(18)15-10-4-6-12-17(15)19(20)14-8-2-1-3-9-14/h1-13H
(3)InChIKey: DLMIWIDZMSLNNJ-UHFFFAOYAP
(4)Std. InChI: InChI=1S/C20H13I/c21-20-18-13-7-5-11-16(18)15-10-4-6-12-17(15)19(20)14-8-2-1-3-9-14/h1-13H
(5)Std. InChIKey: DLMIWIDZMSLNNJ-UHFFFAOYSA-N