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Predicted properties of the compound entered.

ID GFBCBQNBXRPRQD-JLHYYAGUSA-N
Formula C13H16O
IUPAC Name (2E)-2-(phenylmethylidene)hexanal
SMILES
Standard InChI
Standard InChIKey
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Other Names and Identifiers
Standard InChI (User Input) InChI=1S/C13H16O/c1-2-3-7-13(11-14)10-12-8-5-4-6-9-12/h4-6,8-11H,2-3,7H2,1H3/b13-10+
Standard InChIKey (User Input) InChIKey=GFBCBQNBXRPRQD-JLHYYAGUSA-N
Non-Standard InChI
Non-Standard InChIKey
Other Names and Identifiers (2E)-2-(phenylmethylidene)hexanal | 2-(phenylmethylidene)hexanal | (2E)-2-(phenylmethylene)hexanal | 2-(Phenylmethylene)hexanal | 2-butyl-3-phenyl-acrolein | (E)-2-butyl-3-phenyl-acrolein | 7492-44-6 | 3-07-00-01486 (Beilstein Handbook Reference) | AI3-05072 | BRN 3241532 | Butyl cinnamic aldehyde | CINNAMALDEHYDE, alpha-BUTYL- | EINECS 231-320-0 | FEMA No. 2191 | Hexanal, 2-(phenylmethylene)- | NSC 406674 | alpha-Butyl-beta-phenylacrolein | alpha-Butylcinnamaldehyde | alpha-Butylcinnamic aldehyde | alpha-n-Butyl-beta-phenylacrolein | Cinnamaldehyde, .alpha.-butyl- | NSC406674 | .alpha.-Butylcinnamaldehyde | .alpha.-Butylcinnamic aldehyde | 2-Benzylidenehexanal
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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 - - -
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13C NMR prediction -
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