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Predicted properties of the compound entered.

ID QJKFMLQOFBGTIQ-UHFFFAOYSA-N
Formula C75H98
IUPAC Name 2,7-bis(9,9-dihexyl-9H-fluoren-2-yl)-9,9-dihexyl-9H-fluorene
SMILES
Standard InChI
Standard InChIKey
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Other Names and Identifiers
Standard InChI (User Input) InChI=1S/C75H98/c1-7-13-19-29-47-73(48-30-20-14-8-2)67-37-27-25-35-61(67)63-43-39-57(53-69(63)73)59-41-45-65-66-46-42-60(56-72(66)75(71(65)55-59,51-33-23-17-11-5)52-34-24-18-12-6)58-40-44-64-62-36-26-28-38-68(62)74(70(64)54-58,49-31-21-15-9-3)50-32-22-16-10-4/h25-28,35-46,53-56H,7-24,29-34,47-52H2,1-6H3
Standard InChIKey (User Input) InChIKey=QJKFMLQOFBGTIQ-UHFFFAOYSA-N
Non-Standard InChI
Non-Standard InChIKey
Other Names and Identifiers
For more property data (~2,100 data sets per compound) with higher accuracy , try our new database.
Mol-Instincts Database
 
Property Value Unit Accuracy
Absolute Entropy of Ideal Gas at 298.15K and 1bar - - -
Acentric Factor - - -
Critical Compressibility Factor - - -
Critical Pressure - - -
Critical Temperature - - -
Critical Volume - - -
Enthalpy of Formation for Ideal Gas at 298.15K - - -
Liquid Molar Volume at 298.15K - - -
Molecular Weight - - -
Net Standard State Enthalpy of Combustion at 298.15K - - -
Normal Boiling Point - - -
Melting Point - - -
Refractive Index - - -
Solubility Parameter at 298.15K - - -
Standard State Absolute Entropy at 298.15K and 1bar - - -
Standard State Enthalpy of Formation at 298.15K and 1bar - - -
Magnetic Susceptibility - - -
Polarizability - - -
Flash Point - - -
Parachor - - -
Lower Flammability Limit Temperature - - -
Lower Flammability Limit Volume Percent - - -
Upper Flammability Limit Temperature - - -
Upper Flammability Limit Volume Percent - - -
Liquid Density at Normal Boiling Point - - -
Heat of Vaporization at 298.15K - - -
Heat of Vaporization at Normal Boiling Point - - -
Water Solubility - - -
For professional applications, try our new chemical database based on quantum mechanics - more property data (~2,100 data sets per compound) with higher accuracy.

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1H NMR prediction -
13C NMR prediction -
COSY -
HSQC/HMBC prediction -
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