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35608-64-1

35608-64-1 structural image
Product Name: ETHYL 3-HYDROXYBUTYRATE
Formula: C6H12O3
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Ethyl 3-hydroxybutyrate is a clear colorless liquid. (NTP, 1992)
Boiling Point 338 °F at 760 mmHg (NTP, 1992)
Flash Point 148 °F (NTP, 1992)
Solubility greater than or equal to 100 mg/mL at 73 °F (NTP, 1992)
Density 1.017 (NTP, 1992) - Denser than water; will sink
Refractive Index 1.416-1.424
Kovats Retention Index 949 943 907 907 912 921 928 920 908 912

COMPUTED DESCRIPTORS

Molecular Weight 132.16 g/mol
XLogP3 0.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 4
Exact Mass 132.078644241 g/mol
Monoisotopic Mass 132.078644241 g/mol
Topological Polar Surface Area 46.5 Ų
Heavy Atom Count 9
Formal Charge 0
Complexity 90.3
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Ethyl 3-hydroxybutyrate is a clear colorless liquid. (NTP, 1992)