CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Liquid |
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Color/Form | Pale-yellow, viscous liquid |
Odor | Slight phenolic odor |
Boiling Point | 293-297 °C |
Melting Point | Freezing point: -10 °C (sets to glass below this temperature) |
Flash Point | 285 °F |
Solubility | In water, 4.90 mg/L at 25 °C |
Density | 0.950 at 20 °C/4 °C |
Vapor Density | 7.59 (Air = 1) |
Vapor Pressure | 0.000024 [mmHg] |
LogP | log Kow = 5.71 (average of 3 isomers) |
Decomposition | When heated to decomp it emits acrid smoke and irritating fumes. |
Viscosity | 563 cP at 20 °C |
Heat of Vaporization | 9.8113 J/kmol at 279.15 K |
Surface Tension | ESTIMATED 30 DYNES/CM= 0.03 N/M @ 20 °C |
Refractive Index | Index of refraction: 1.513 at 20 °C/D |
Dissociation Constants | pKa = 10.25 |
Other Experimental Properties | Comparatively high viscosity. |
Chemical Classes | Other Classes -> Phenols |
COMPUTED DESCRIPTORS
Molecular Weight | 220.35 g/mol |
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XLogP3 | 6.2 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 1 |
Rotatable Bond Count | 8 |
Exact Mass | 220.182715385 g/mol |
Monoisotopic Mass | 220.182715385 g/mol |
Topological Polar Surface Area | 20.2 Ų |
Heavy Atom Count | 16 |
Formal Charge | 0 |
Complexity | 156 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
2-Nonylphenol is a natural product found in Paeonia lactiflora with data available.