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67254-79-9

Product Name: Fattyacids:conjugated,synthetic
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Butyric acid appears as a colorless liquid with a penetrating and unpleasant odor. Flash point 170 °F. Corrosive to metals and tissue. Density 8.0 lb /gal.
Color/Form Oily liquid
Odor Unpleasant, rancid odor
Taste Butter-fat taste
Boiling Point 326.3 °F at 760 mmHg (NTP, 1992)
Melting Point 17.8 °F (NTP, 1992)
Flash Point 170 °F (NTP, 1992)
Solubility greater than or equal to 100 mg/mL at 66 °F (NTP, 1992)
Density 0.958 at 68 °F (USCG, 1999) - Less dense than water; will float
Vapor Density 3.04 (NTP, 1992) - Heavier than air; will sink (Relative to Air)
Vapor Pressure 0.43 mmHg at 68 °F ; 1.4 mmHg at 86 °F (NTP, 1992)
LogP 0.79
LogS -0.19
Stability/Shelf Life It has good stability
Autoignition Temperature 842 °F (USCG, 1999)
Viscosity 1.426 mPa-s at 25 °C
Corrosivity Corrosive material
Heat of Combustion 521.87 kg cal/gm at 25 °C
Heat of Vaporization 40.45 kJ/mol at 25 °C
Surface Tension 26.05 mN/m at 25 °C
Odor Threshold 0.001 mg/cu m (Odor low) 9 mg/cu m (Odor high)
Refractive Index Index of refraction: 1.3991 at 20 °C/D
Dissociation Constants 4.82 (at 25 °C)
Kovats Retention Index 780 856 826 830 814 778 823 823 828 834 804 824 823 800 786 775.6 802 809 803 820 780 797 797 795
Other Experimental Properties Heat capacity = 178.6 J/mol-K at 25 °C. Heat capacity = 178.6 J/mol-K at 25 °C
Chemical Classes Other Classes -> Organic Acids

COMPUTED DESCRIPTORS

Molecular Weight 88.11 g/mol
XLogP3 0.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 2
Exact Mass 88.052429494 g/mol
Monoisotopic Mass 88.052429494 g/mol
Topological Polar Surface Area 37.3 Ų
Heavy Atom Count 6
Formal Charge 0
Complexity 49.5
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

Butyric acid appears as a colorless liquid with a penetrating and unpleasant odor. Flash point 170 °F. Corrosive to metals and tissue. Density 8.0 lb /gal.