CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Solid |
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Melting Point | 133 °C |
Solubility | 40 mg/L @ 25 °C (exp) |
COMPUTED DESCRIPTORS
Molecular Weight | 258.27 g/mol |
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XLogP3 | 2.8 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 1 |
Exact Mass | 258.08920892 g/mol |
Monoisotopic Mass | 258.08920892 g/mol |
Topological Polar Surface Area | 44.8 Ų |
Heavy Atom Count | 19 |
Formal Charge | 0 |
Complexity | 437 |
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
Xanthoxyletin is a member of coumarins. It has a role as a metabolite.