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16568-02-8

16568-02-8 structural image
Product Name: gyromitrin
Formula: C4H8N2O
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Colorless liquid; [HSDB]
Color/Form COLORLESS LIQ
Boiling Point 143 °C
Melting Point 19.5 °C (VACUUM)
Solubility SOL IN ACETONE, BENZENE, CARBON TETRACHLORIDE, CHLOROFORM, DIETHYL ETHER, ETHANOL, ETHYL ACETATE, METHANOL, DICHLOROMETHANE AND WATER
Density 1.05 @ 20 °C
Stability/Shelf Life VERY SENSITIVE TO AIR OXIDATION; SENSITIVE TO HYDROLYSIS BY BOTH ACIDS AND ALKALIS
Other Experimental Properties Very sensitive to air oxidation (starts at -25 °C); sensitive to hydrolysis by both acids and alkalis.
Chemical Classes Biological Agents -> Mushroom Toxins

COMPUTED DESCRIPTORS

Molecular Weight 100.12 g/mol
XLogP3 -0.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 1
Exact Mass 100.063662883 g/mol
Monoisotopic Mass 100.063662883 g/mol
Topological Polar Surface Area 32.7 Ų
Heavy Atom Count 7
Formal Charge 0
Complexity 79.8
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Gyromitrin is a hydrazone and an aldehyde. It is functionally related to an acetaldehyde hydrazone.